Product OPENEYE NAME: [(1S,3aR,6E,9S,9aR,10R,11aS)-6-[[tert-butyl-[3-(dimethylamino)propyl]amino]methylene]-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-10-yl] acetate
CAS Name: acetic acid [(1S,3aR,6E,9S,9aR,10R,11aS)-6-[[tert-butyl-[3-(dimethylamino)propyl]amino]methylidene]-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h][2]benzopyran-10-yl] ester
IUPAC NAME: [(1S,3aR,6E,9S,9aR,10R,11aS)-6-[[tert-butyl-[3-(dimethylamino)propyl]amino]methylidene]-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-10-yl] acetate
SYSTEMATIC NAME: [(1S,3aR,6E,9S,9aR,10R,11aS)-6-[[tert-butyl-[3-(dimethylamino)propyl]amino]methylidene]-9-(methoxymethyl)-9a,11a-dimethyl-1,5-bis(oxidanyl)-4,7-bis(oxidanylidene)-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-10-yl] ethanoate
MOLECULAR FORMULA: C32H48N2O8
MOLECULAR WEIGHT: 588.73212
SMILES: CC(=O)O[C@@H]1C[C@]2([C@@H](CC[C@@H]2O)C3=C1[C@]4([C@H](OC(=O)/C(=C/N(CCCN(C)C)C(C)(C)C)/C4=C(C3=O)O)COC)C)C
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Product OPENEYE NAME: methyl N-[(1S)-1-[[[(2R)-2-benzyl-2-hydroxy-3-[[(1S,2R)-2-hydroxyindan-1-yl]amino]-3-oxo-propyl]-[(4-bromophenyl)methyl]amino]carbamoyl]-2,2-dimethyl-propyl]carbamate
CAS Name: N-[(2S)-1-[2-[(4-bromophenyl)methyl]-2-[(2R)-2-hydroxy-3-[[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]-3-oxo-2-(phenylmethyl)propyl]hydrazinyl]-3,3-dimethyl-1-oxobutan-2-yl]carbamic acid methyl ester
IUPAC NAME: methyl N-[(2S)-1-[2-[(2R)-2-benzyl-2-hydroxy-3-[[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]-3-oxopropyl]-2-[(4-bromophenyl)methyl]hydrazinyl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate
SYSTEMATIC NAME: methyl N-[(2S)-1-[2-[(4-bromophenyl)methyl]-2-[(2R)-2-oxidanyl-3-[[(1S,2R)-2-oxidanyl-2,3-dihydro-1H-inden-1-yl]amino]-3-oxidanylidene-2-(phenylmethyl)propyl]hydrazinyl]-3,3-dimethyl-1-oxidanylidene-butan-2-yl]carbamate
MOLECULAR FORMULA: C34H41BrN4O6
MOLECULAR WEIGHT: 681.61654
SMILES: CC(C)(C)[C@@H](C(=O)NN(CC1=CC=C(C=C1)Br)C[C@](CC2=CC=CC=C2)(C(=O)N[C@@H]3[C@@H](CC4=CC=CC=C34)O)O)NC(=O)OC
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Product OPENEYE NAME: 5-cyclopentadecylidenepentyl [(1S,2S)-2-(trimethylammonio)cyclohexyl] phosphate
CAS Name: 5-cyclopentadecylidenepentyl [(1S,2S)-2-(trimethylammonio)cyclohexyl] phosphate
IUPAC NAME: 5-cyclopentadecylidenepentyl [(1S,2S)-2-(trimethylazaniumyl)cyclohexyl] phosphate
SYSTEMATIC NAME: 5-cyclopentadecylidenepentyl [(1S,2S)-2-(trimethylazaniumyl)cyclohexyl] phosphate
MOLECULAR FORMULA: C29H56NO4P
MOLECULAR WEIGHT: 513.733001
SMILES: C[N+](C)(C)[C@H]1CCCC[C@@H]1OP(=O)([O-])OCCCCC=C2CCCCCCCCCCCCCC2
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Product OPENEYE NAME: [(1S,2S)-2-[5-cyclopentadecylidenepentoxy(hydroxy)phosphoryl]oxycyclohexyl]-trimethyl-ammonium
CAS Name: [(1S,2S)-2-[5-cyclopentadecylidenepentoxy(hydroxy)phosphoryl]oxycyclohexyl]-trimethylammonium
IUPAC NAME: [(1S,2S)-2-[5-cyclopentadecylidenepentoxy(hydroxy)phosphoryl]oxycyclohexyl]-trimethylazanium
SYSTEMATIC NAME: [(1S,2S)-2-[5-cyclopentadecylidenepentoxy(oxidanyl)phosphoryl]oxycyclohexyl]-trimethyl-azanium
MOLECULAR FORMULA: C29H57NO4P+
MOLECULAR WEIGHT: 514.740941
SMILES: C[N+](C)(C)[C@H]1CCCC[C@@H]1OP(=O)(O)OCCCCC=C2CCCCCCCCCCCCCC2
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Product OPENEYE NAME: [(1S,3aR,6E,9S,9aR,10R,11aS)-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-6-[[4-(1-piperidyl)-1-piperidyl]methylene]-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-10-yl] acetate
CAS Name: acetic acid [(1S,3aR,6E,9S,9aR,10R,11aS)-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-6-[[4-(1-piperidinyl)-1-piperidinyl]methylidene]-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h][2]benzopyran-10-yl] ester
IUPAC NAME: [(1S,3aR,6E,9S,9aR,10R,11aS)-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-6-[(4-piperidin-1-ylpiperidin-1-yl)methylidene]-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-10-yl] acetate
SYSTEMATIC NAME: [(1S,3aR,6E,9S,9aR,10R,11aS)-9-(methoxymethyl)-9a,11a-dimethyl-1,5-bis(oxidanyl)-4,7-bis(oxidanylidene)-6-[(4-piperidin-1-ylpiperidin-1-yl)methylidene]-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-10-yl] ethanoate
MOLECULAR FORMULA: C33H46N2O8
MOLECULAR WEIGHT: 598.72694
SMILES: CC(=O)O[C@@H]1C[C@]2([C@@H](CC[C@@H]2O)C3=C1[C@]4([C@H](OC(=O)/C(=C/N5CCC(CC5)N6CCCCC6)/C4=C(C3=O)O)COC)C)C
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Product OPENEYE NAME: acetic acid; (2S)-2-amino-5-[[amino(hydrazino)methylene]amino]pentanoic acid
CAS Name: acetic acid; (2S)-2-amino-5-[[amino(hydrazinyl)methylidene]amino]pentanoic acid
IUPAC NAME: acetic acid; (2S)-2-amino-5-[[amino(hydrazinyl)methylidene]amino]pentanoic acid
SYSTEMATIC NAME: (2S)-2-azanyl-5-[[azanyl(diazanyl)methylidene]amino]pentanoic acid; ethanoic acid
MOLECULAR FORMULA: C8H19N5O4
MOLECULAR WEIGHT: 249.26756
SMILES: CC(=O)O.C(C[C@@H](C(=O)O)N)CN=C(N)NN
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Product OPENEYE NAME: 1-[(E)-[(1S,3aR,9S,9aR,10R,11aS)-10-acetoxy-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-6-ylidene]methyl]piperidine-4-carboxylic acid
CAS Name: 1-[(E)-[(1S,3aR,9S,9aR,10R,11aS)-10-acetyloxy-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h][2]benzopyran-6-ylidene]methyl]-4-piperidinecarboxylic acid
IUPAC NAME: 1-[(E)-[(1S,3aR,9S,9aR,10R,11aS)-10-acetyloxy-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-6-ylidene]methyl]piperidine-4-carboxylic acid
SYSTEMATIC NAME: 1-[(E)-[(1S,3aR,9S,9aR,10R,11aS)-10-acetyloxy-9-(methoxymethyl)-9a,11a-dimethyl-1,5-bis(oxidanyl)-4,7-bis(oxidanylidene)-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-6-ylidene]methyl]piperidine-4-carboxylic acid
MOLECULAR FORMULA: C29H37NO10
MOLECULAR WEIGHT: 559.60478
SMILES: CC(=O)O[C@@H]1C[C@]2([C@@H](CC[C@@H]2O)C3=C1[C@]4([C@H](OC(=O)/C(=C/N5CCC(CC5)C(=O)O)/C4=C(C3=O)O)COC)C)C
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Product OPENEYE NAME: 4-ethynylbenzenesulfonamide
CAS Name: 4-ethynylbenzenesulfonamide
IUPAC NAME: 4-ethynylbenzenesulfonamide
SYSTEMATIC NAME: 4-ethynylbenzenesulfonamide
MOLECULAR FORMULA: C8H7NO2S
MOLECULAR WEIGHT: 181.21168
SMILES: C#CC1=CC=C(C=C1)S(=O)(=O)N
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Product OPENEYE NAME: [(3aS,5S,5aS,8aR,9S,9aS)-8-acetoxy-9-hydroxy-5,8a-dimethyl-1-methylene-2-oxo-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-6-yl] acetate
CAS Name: acetic acid [(3aS,5S,5aS,8aR,9S,9aS)-8-acetyloxy-9-hydroxy-5,8a-dimethyl-1-methylene-2-oxo-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-6-yl] ester
IUPAC NAME: [(3aS,5S,5aS,8aR,9S,9aS)-8-acetyloxy-9-hydroxy-5,8a-dimethyl-1-methylidene-2-oxo-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-6-yl] acetate
SYSTEMATIC NAME: [(3aS,5S,5aS,8aR,9S,9aS)-8-acetyloxy-5,8a-dimethyl-1-methylidene-9-oxidanyl-2-oxidanylidene-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-6-yl] ethanoate
MOLECULAR FORMULA: C19H26O7
MOLECULAR WEIGHT: 366.40554
SMILES: C[C@H]1C[C@H]2[C@H]([C@@H]([C@]3([C@H]1C(CC3OC(=O)C)OC(=O)C)C)O)C(=C)C(=O)O2
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Product OPENEYE NAME: (3aS,5R,5aS,8aR,9R,9aS)-9-hydroxy-5,8a-dimethyl-1-methylene-3a,4,5,5a,6,7,9,9a-octahydroazuleno[6,7-b]furan-2,8-dione
CAS Name: (3aS,5R,5aS,8aR,9R,9aS)-9-hydroxy-5,8a-dimethyl-1-methylene-3a,4,5,5a,6,7,9,9a-octahydroazuleno[6,7-b]furan-2,8-dione
IUPAC NAME: (3aS,5R,5aS,8aR,9R,9aS)-9-hydroxy-5,8a-dimethyl-1-methylidene-3a,4,5,5a,6,7,9,9a-octahydroazuleno[6,7-b]furan-2,8-dione
SYSTEMATIC NAME: (3aS,5R,5aS,8aR,9R,9aS)-5,8a-dimethyl-1-methylidene-9-oxidanyl-3a,4,5,5a,6,7,9,9a-octahydroazuleno[6,7-b]furan-2,8-dione
MOLECULAR FORMULA: C15H20O4
MOLECULAR WEIGHT: 264.3169
SMILES: C[C@@H]1C[C@H]2[C@H]([C@H]([C@]3([C@H]1CCC3=O)C)O)C(=C)C(=O)O2
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Product OPENEYE NAME: (3aS,5R,5aS,7R,8R,8aR,9R,9aS)-7,8,9-trihydroxy-5,8a-dimethyl-1-methylene-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one
CAS Name: (3aS,5R,5aS,7R,8R,8aR,9R,9aS)-7,8,9-trihydroxy-5,8a-dimethyl-1-methylene-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one
IUPAC NAME: (3aS,5R,5aS,7R,8R,8aR,9R,9aS)-7,8,9-trihydroxy-5,8a-dimethyl-1-methylidene-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one
SYSTEMATIC NAME: (3aS,5R,5aS,7R,8R,8aR,9R,9aS)-5,8a-dimethyl-1-methylidene-7,8,9-tris(oxidanyl)-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-2-one
MOLECULAR FORMULA: C15H22O5
MOLECULAR WEIGHT: 282.33218
SMILES: C[C@@H]1C[C@H]2[C@H]([C@H]([C@]3([C@H]1C[C@H]([C@@H]3O)O)C)O)C(=C)C(=O)O2
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Product OPENEYE NAME: [(3aR,4R,6E,9S,10E,11aS)-9-acetoxy-6,10-dimethyl-3-methylene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 3-acetoxy-2-hydroxy-2-methyl-butanoate
CAS Name: 3-acetyloxy-2-hydroxy-2-methylbutanoic acid [(3aR,4R,6E,9S,10E,11aS)-9-acetyloxy-6,10-dimethyl-3-methylene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] ester
IUPAC NAME: [(3aR,4R,6E,9S,10E,11aS)-9-acetyloxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 3-acetyloxy-2-hydroxy-2-methylbutanoate
SYSTEMATIC NAME: [(3aR,4R,6E,9S,10E,11aS)-9-acetyloxy-6,10-dimethyl-3-methylidene-2-oxidanylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 3-acetyloxy-2-methyl-2-oxidanyl-butanoate
MOLECULAR FORMULA: C24H32O9
MOLECULAR WEIGHT: 464.50548
SMILES: C/C/1=C\C[C@@H](/C(=C/[C@H]2[C@@H]([C@@H](C1)OC(=O)C(C)(C(C)OC(=O)C)O)C(=C)C(=O)O2)/C)OC(=O)C
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Product OPENEYE NAME: [(3aR,4R,6E,9S,10E,11aS)-9-acetoxy-6,10-dimethyl-3-methylene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2,3-dimethyloxirane-2-carboxylate
CAS Name: 2,3-dimethyl-2-oxiranecarboxylic acid [(3aR,4R,6E,9S,10E,11aS)-9-acetyloxy-6,10-dimethyl-3-methylene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] ester
IUPAC NAME: [(3aR,4R,6E,9S,10E,11aS)-9-acetyloxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2,3-dimethyloxirane-2-carboxylate
SYSTEMATIC NAME: [(3aR,4R,6E,9S,10E,11aS)-9-acetyloxy-6,10-dimethyl-3-methylidene-2-oxidanylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2,3-dimethyloxirane-2-carboxylate
MOLECULAR FORMULA: C22H28O7
MOLECULAR WEIGHT: 404.45352
SMILES: CC1C(O1)(C)C(=O)O[C@@H]2C/C(=C/C[C@@H](/C(=C/[C@H]3[C@@H]2C(=C)C(=O)O3)/C)OC(=O)C)/C
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Product OPENEYE NAME: methyl N-[(1S)-1-[[[(2R)-2-benzyl-2-hydroxy-3-[[(1S,2R)-2-hydroxyindan-1-yl]amino]-3-oxo-propyl]-[[4-(3-pyridyl)phenyl]methyl]amino]carbamoyl]-2,2-dimethyl-propyl]carbamate
CAS Name: N-[(2S)-1-[2-[(2R)-2-hydroxy-3-[[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]-3-oxo-2-(phenylmethyl)propyl]-2-[[4-(3-pyridinyl)phenyl]methyl]hydrazinyl]-3,3-dimethyl-1-oxobutan-2-yl]carbamic acid methyl ester
IUPAC NAME: methyl N-[(2S)-1-[2-[(2R)-2-benzyl-2-hydroxy-3-[[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]-3-oxopropyl]-2-[(4-pyridin-3-ylphenyl)methyl]hydrazinyl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate
SYSTEMATIC NAME: methyl N-[(2S)-3,3-dimethyl-1-oxidanylidene-1-[2-[(2R)-2-oxidanyl-3-[[(1S,2R)-2-oxidanyl-2,3-dihydro-1H-inden-1-yl]amino]-3-oxidanylidene-2-(phenylmethyl)propyl]-2-[(4-pyridin-3-ylphenyl)methyl]hydrazinyl]butan-2-yl]carbamate
MOLECULAR FORMULA: C39H45N5O6
MOLECULAR WEIGHT: 679.8045
SMILES: CC(C)(C)[C@@H](C(=O)NN(CC1=CC=C(C=C1)C2=CN=CC=C2)C[C@](CC3=CC=CC=C3)(C(=O)N[C@@H]4[C@@H](CC5=CC=CC=C45)O)O)NC(=O)OC
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Product OPENEYE NAME: 5-cyclopentadecylidenepentyl [(1S,2S)-2-(trimethylammonio)cyclopentyl] phosphate
CAS Name: 5-cyclopentadecylidenepentyl [(1S,2S)-2-(trimethylammonio)cyclopentyl] phosphate
IUPAC NAME: 5-cyclopentadecylidenepentyl [(1S,2S)-2-(trimethylazaniumyl)cyclopentyl] phosphate
SYSTEMATIC NAME: 5-cyclopentadecylidenepentyl [(1S,2S)-2-(trimethylazaniumyl)cyclopentyl] phosphate
MOLECULAR FORMULA: C28H54NO4P
MOLECULAR WEIGHT: 499.706421
SMILES: C[N+](C)(C)[C@H]1CCC[C@@H]1OP(=O)([O-])OCCCCC=C2CCCCCCCCCCCCCC2
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Product OPENEYE NAME: [(1S,2S)-2-[5-cyclopentadecylidenepentoxy(hydroxy)phosphoryl]oxycyclopentyl]-trimethyl-ammonium
CAS Name: [(1S,2S)-2-[5-cyclopentadecylidenepentoxy(hydroxy)phosphoryl]oxycyclopentyl]-trimethylammonium
IUPAC NAME: [(1S,2S)-2-[5-cyclopentadecylidenepentoxy(hydroxy)phosphoryl]oxycyclopentyl]-trimethylazanium
SYSTEMATIC NAME: [(1S,2S)-2-[5-cyclopentadecylidenepentoxy(oxidanyl)phosphoryl]oxycyclopentyl]-trimethyl-azanium
MOLECULAR FORMULA: C28H55NO4P+
MOLECULAR WEIGHT: 500.714361
SMILES: C[N+](C)(C)[C@H]1CCC[C@@H]1OP(=O)(O)OCCCCC=C2CCCCCCCCCCCCCC2
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Product OPENEYE NAME: [(1S,3aR,6E,9S,9aR,10R,11aS)-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-6-[(4-phenyl-1-piperidyl)methylene]-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-10-yl] acetate
CAS Name: acetic acid [(1S,3aR,6E,9S,9aR,10R,11aS)-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-6-[(4-phenyl-1-piperidinyl)methylidene]-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h][2]benzopyran-10-yl] ester
IUPAC NAME: [(1S,3aR,6E,9S,9aR,10R,11aS)-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-6-[(4-phenylpiperidin-1-yl)methylidene]-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-10-yl] acetate
SYSTEMATIC NAME: [(1S,3aR,6E,9S,9aR,10R,11aS)-9-(methoxymethyl)-9a,11a-dimethyl-1,5-bis(oxidanyl)-4,7-bis(oxidanylidene)-6-[(4-phenylpiperidin-1-yl)methylidene]-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-10-yl] ethanoate
MOLECULAR FORMULA: C34H41NO8
MOLECULAR WEIGHT: 591.69124
SMILES: CC(=O)O[C@@H]1C[C@]2([C@@H](CC[C@@H]2O)C3=C1[C@]4([C@H](OC(=O)/C(=C/N5CCC(CC5)C6=CC=CC=C6)/C4=C(C3=O)O)COC)C)C
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Product OPENEYE NAME: methyl 1-[(E)-[(1S,3aR,9S,9aR,10R,11aS)-10-acetoxy-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-6-ylidene]methyl]piperidine-4-carboxylate
CAS Name: 1-[(E)-[(1S,3aR,9S,9aR,10R,11aS)-10-acetyloxy-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h][2]benzopyran-6-ylidene]methyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[(E)-[(1S,3aR,9S,9aR,10R,11aS)-10-acetyloxy-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-6-ylidene]methyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[(E)-[(1S,3aR,9S,9aR,10R,11aS)-10-acetyloxy-9-(methoxymethyl)-9a,11a-dimethyl-1,5-bis(oxidanyl)-4,7-bis(oxidanylidene)-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-6-ylidene]methyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C30H39NO10
MOLECULAR WEIGHT: 573.63136
SMILES: CC(=O)O[C@@H]1C[C@]2([C@@H](CC[C@@H]2O)C3=C1[C@]4([C@H](OC(=O)/C(=C/N5CCC(CC5)C(=O)OC)/C4=C(C3=O)O)COC)C)C
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Product OPENEYE NAME: [(1R,2S)-2-aminocyclohexyl]carbamoylphosphonic acid
CAS Name: [[[(1R,2S)-2-aminocyclohexyl]amino]-oxomethyl]phosphonic acid
IUPAC NAME: [(1R,2S)-2-aminocyclohexyl]carbamoylphosphonic acid
SYSTEMATIC NAME: [(1R,2S)-2-azanylcyclohexyl]carbamoylphosphonic acid
MOLECULAR FORMULA: C7H15N2O4P
MOLECULAR WEIGHT: 222.178761
SMILES: C1CC[C@H]([C@H](C1)N)NC(=O)P(=O)(O)O
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Product OPENEYE NAME: [(1S,3aR,6E,9S,9aR,10R,11aS)-6-[[4-[3-(dimethylamino)propyl]piperazin-1-yl]methylene]-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-10-yl] acetate
CAS Name: acetic acid [(1S,3aR,6E,9S,9aR,10R,11aS)-6-[[4-[3-(dimethylamino)propyl]-1-piperazinyl]methylidene]-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h][2]benzopyran-10-yl] ester
IUPAC NAME: [(1S,3aR,6E,9S,9aR,10R,11aS)-6-[[4-[3-(dimethylamino)propyl]piperazin-1-yl]methylidene]-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-4,7-dioxo-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-10-yl] acetate
SYSTEMATIC NAME: [(1S,3aR,6E,9S,9aR,10R,11aS)-6-[[4-[3-(dimethylamino)propyl]piperazin-1-yl]methylidene]-9-(methoxymethyl)-9a,11a-dimethyl-1,5-bis(oxidanyl)-4,7-bis(oxidanylidene)-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-10-yl] ethanoate
MOLECULAR FORMULA: C32H47N3O8
MOLECULAR WEIGHT: 601.73088
SMILES: CC(=O)O[C@@H]1C[C@]2([C@@H](CC[C@@H]2O)C3=C1[C@]4([C@H](OC(=O)/C(=C/N5CCN(CC5)CCCN(C)C)/C4=C(C3=O)O)COC)C)C
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Product OPENEYE NAME: [(1S,3aR,6E,9S,9aR,10R,11aS)-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-6-[[4-(2-morpholinoethyl)piperazin-1-yl]methylene]-4,7-dioxo-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-10-yl] acetate
CAS Name: acetic acid [(1S,3aR,6E,9S,9aR,10R,11aS)-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-6-[[4-[2-(4-morpholinyl)ethyl]-1-piperazinyl]methylidene]-4,7-dioxo-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h][2]benzopyran-10-yl] ester
IUPAC NAME: [(1S,3aR,6E,9S,9aR,10R,11aS)-1,5-dihydroxy-9-(methoxymethyl)-9a,11a-dimethyl-6-[[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methylidene]-4,7-dioxo-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-10-yl] acetate
SYSTEMATIC NAME: [(1S,3aR,6E,9S,9aR,10R,11aS)-9-(methoxymethyl)-9a,11a-dimethyl-6-[[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methylidene]-1,5-bis(oxidanyl)-4,7-bis(oxidanylidene)-2,3,3a,9,10,11-hexahydro-1H-indeno[4,5-h]isochromen-10-yl] ethanoate
MOLECULAR FORMULA: C33H47N3O9
MOLECULAR WEIGHT: 629.74098
SMILES: CC(=O)O[C@@H]1C[C@]2([C@@H](CC[C@@H]2O)C3=C1[C@]4([C@H](OC(=O)/C(=C/N5CCN(CC5)CCN6CCOCC6)/C4=C(C3=O)O)COC)C)C
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