Product OPENEYE NAME: 3-[15,21-bis(2-amino-2-oxo-ethyl)-3-(1-hydroxyethyl)-6,12-bis(hydroxymethyl)-18-[(4-hydroxyphenyl)methyl]-25-(10-methylundecyl)-2,5,8,11,14,17,20,23-octaoxo-1,4,7,10,13,16,19,22-octazacyclopentacos-9-yl]propanoic acid
CAS Name: 3-[15,21-bis(2-amino-2-oxoethyl)-3-(1-hydroxyethyl)-6,12-bis(hydroxymethyl)-18-[(4-hydroxyphenyl)methyl]-25-(10-methylundecyl)-2,5,8,11,14,17,20,23-octaoxo-1,4,7,10,13,16,19,22-octazacyclopentacos-9-yl]propanoic acid
IUPAC NAME: 3-[15,21-bis(2-amino-2-oxoethyl)-3-(1-hydroxyethyl)-6,12-bis(hydroxymethyl)-18-[(4-hydroxyphenyl)methyl]-25-(10-methylundecyl)-2,5,8,11,14,17,20,23-octaoxo-1,4,7,10,13,16,19,22-octazacyclopentacos-9-yl]propanoic acid
SYSTEMATIC NAME: 3-[15,21-bis(2-azanyl-2-oxidanylidene-ethyl)-3-(1-hydroxyethyl)-6,12-bis(hydroxymethyl)-18-[(4-hydroxyphenyl)methyl]-25-(10-methylundecyl)-2,5,8,11,14,17,20,23-octakis(oxidanylidene)-1,4,7,10,13,16,19,22-octazacyclopentacos-9-yl]propanoic acid
MOLECULAR FORMULA: C47H74N10O16
MOLECULAR WEIGHT: 1035.14786
SMILES: CC(C)CCCCCCCCCC1CC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)C(C)O)CO)CCC(=O)O)CO)CC(=O)N)CC2=CC=C(C=C2)O)CC(=O)N
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Product OPENEYE NAME: 3-[15,21-bis(2-amino-2-oxo-ethyl)-3-(1-hydroxyethyl)-6,12-bis(hydroxymethyl)-18-[(4-hydroxyphenyl)methyl]-25-(10-methyldodecyl)-2,5,8,11,14,17,20,23-octaoxo-1,4,7,10,13,16,19,22-octazacyclopentacos-9-yl]propanoic acid
CAS Name: 3-[15,21-bis(2-amino-2-oxoethyl)-3-(1-hydroxyethyl)-6,12-bis(hydroxymethyl)-18-[(4-hydroxyphenyl)methyl]-25-(10-methyldodecyl)-2,5,8,11,14,17,20,23-octaoxo-1,4,7,10,13,16,19,22-octazacyclopentacos-9-yl]propanoic acid
IUPAC NAME: 3-[15,21-bis(2-amino-2-oxoethyl)-3-(1-hydroxyethyl)-6,12-bis(hydroxymethyl)-18-[(4-hydroxyphenyl)methyl]-25-(10-methyldodecyl)-2,5,8,11,14,17,20,23-octaoxo-1,4,7,10,13,16,19,22-octazacyclopentacos-9-yl]propanoic acid
SYSTEMATIC NAME: 3-[15,21-bis(2-azanyl-2-oxidanylidene-ethyl)-3-(1-hydroxyethyl)-6,12-bis(hydroxymethyl)-18-[(4-hydroxyphenyl)methyl]-25-(10-methyldodecyl)-2,5,8,11,14,17,20,23-octakis(oxidanylidene)-1,4,7,10,13,16,19,22-octazacyclopentacos-9-yl]propanoic acid
MOLECULAR FORMULA: C48H76N10O16
MOLECULAR WEIGHT: 1049.17444
SMILES: CCC(C)CCCCCCCCCC1CC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)C(C)O)CO)CCC(=O)O)CO)CC(=O)N)CC2=CC=C(C=C2)O)CC(=O)N
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Product OPENEYE NAME: [6-(hydroxymethyl)-4-methoxy-6,9a-dimethyl-3-oxo-4,5,5a,7,8,9-hexahydro-1H-benzo[e]isobenzofuran-5-yl] benzoate
CAS Name: benzoic acid [6-(hydroxymethyl)-4-methoxy-6,9a-dimethyl-3-oxo-4,5,5a,7,8,9-hexahydro-1H-benzo[e]isobenzofuran-5-yl] ester
IUPAC NAME: [6-(hydroxymethyl)-4-methoxy-6,9a-dimethyl-3-oxo-4,5,5a,7,8,9-hexahydro-1H-benzo[e][2]benzofuran-5-yl] benzoate
SYSTEMATIC NAME: [6-(hydroxymethyl)-4-methoxy-6,9a-dimethyl-3-oxidanylidene-4,5,5a,7,8,9-hexahydro-1H-benzo[e][2]benzofuran-5-yl] benzoate
MOLECULAR FORMULA: C23H28O6
MOLECULAR WEIGHT: 400.46482
SMILES: CC1(CCCC2(C1C(C(C3=C2COC3=O)OC)OC(=O)C4=CC=CC=C4)C)CO
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CAS Name:
IUPAC NAME:
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MOLECULAR FORMULA: C21H28O6
MOLECULAR WEIGHT: 376.44342
SMILES: CC1CC2=C(CC3C(O2)(CCC4(C3(C(=O)C5C(C4(C)C)O5)C)O)C)C(=O)O1
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MOLECULAR FORMULA: C21H28O4
MOLECULAR WEIGHT: 344.44462
SMILES: CC1CC2=C(CC3C(O2)(CCC4C3(C(=O)C=CC4(C)C)C)C)C(=O)O1
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Product OPENEYE NAME: 3-[8-(1-hydroxy-1-methyl-ethyl)-3-methoxycarbonyl-3,4a,7,10a-tetramethyl-5-methylene-1,4-dioxo-6,6a,8,9,10,10b-hexahydrobenzo[h]isochromen-7-yl]propanoic acid
CAS Name: 3-[8-(2-hydroxypropan-2-yl)-3-methoxycarbonyl-3,4a,7,10a-tetramethyl-5-methylene-1,4-dioxo-6,6a,8,9,10,10b-hexahydrobenzo[h][2]benzopyran-7-yl]propanoic acid
IUPAC NAME: 3-[8-(2-hydroxypropan-2-yl)-3-methoxycarbonyl-3,4a,7,10a-tetramethyl-5-methylidene-1,4-dioxo-6,6a,8,9,10,10b-hexahydrobenzo[h]isochromen-7-yl]propanoic acid
SYSTEMATIC NAME: 3-[3-methoxycarbonyl-3,4a,7,10a-tetramethyl-5-methylidene-1,4-bis(oxidanylidene)-8-(2-oxidanylpropan-2-yl)-6,6a,8,9,10,10b-hexahydrobenzo[h]isochromen-7-yl]propanoic acid
MOLECULAR FORMULA: C26H38O8
MOLECULAR WEIGHT: 478.57512
SMILES: CC12CCC(C(C1CC(=C)C3(C2C(=O)OC(C3=O)(C)C(=O)OC)C)(C)CCC(=O)O)C(C)(C)O
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Product OPENEYE NAME: 2,4-dihydroxy-6-methyl-3-[(2E,6E)-3,7,11-trimethyl-11-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-dodeca-2,6-dienyl]benzaldehyde
CAS Name: 2,4-dihydroxy-6-methyl-3-[(2E,6E)-3,7,11-trimethyl-11-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]dodeca-2,6-dienyl]benzaldehyde
IUPAC NAME: 2,4-dihydroxy-6-methyl-3-[(2E,6E)-3,7,11-trimethyl-11-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxydodeca-2,6-dienyl]benzaldehyde
SYSTEMATIC NAME: 3-[(2E,6E)-11-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3,7,11-trimethyl-dodeca-2,6-dienyl]-6-methyl-2,4-bis(oxidanyl)benzaldehyde
MOLECULAR FORMULA: C29H44O9
MOLECULAR WEIGHT: 536.65426
SMILES: CC1=CC(=C(C(=C1C=O)O)C/C=C(\C)/CC/C=C(\C)/CCCC(C)(C)OC2C(C(C(C(O2)CO)O)O)O)O
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Product OPENEYE NAME: (7-hydroxy-7-methyl-8-oxo-3-propyl-5,6-dihydro-1H-isochromen-6-yl) 2-hydroxy-4-methoxy-6-methyl-benzoate
CAS Name: 2-hydroxy-4-methoxy-6-methylbenzoic acid (7-hydroxy-7-methyl-8-oxo-3-propyl-5,6-dihydro-1H-2-benzopyran-6-yl) ester
IUPAC NAME: (7-hydroxy-7-methyl-8-oxo-3-propyl-5,6-dihydro-1H-isochromen-6-yl) 2-hydroxy-4-methoxy-6-methylbenzoate
SYSTEMATIC NAME: (7-methyl-7-oxidanyl-8-oxidanylidene-3-propyl-5,6-dihydro-1H-isochromen-6-yl) 4-methoxy-2-methyl-6-oxidanyl-benzoate
MOLECULAR FORMULA: C22H26O7
MOLECULAR WEIGHT: 402.43764
SMILES: CCCC1=CC2=C(CO1)C(=O)C(C(C2)OC(=O)C3=C(C=C(C=C3C)OC)O)(C)O
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Product OPENEYE NAME: methyl 3,5-dimethoxy-2-[5-methoxy-6-(2-methoxypropyl)-4-oxo-pyran-3-carbonyl]benzoate
CAS Name: 3,5-dimethoxy-2-[[5-methoxy-6-(2-methoxypropyl)-4-oxo-3-pyranyl]-oxomethyl]benzoic acid methyl ester
IUPAC NAME: methyl 3,5-dimethoxy-2-[5-methoxy-6-(2-methoxypropyl)-4-oxopyran-3-carbonyl]benzoate
SYSTEMATIC NAME: methyl 3,5-dimethoxy-2-[5-methoxy-6-(2-methoxypropyl)-4-oxidanylidene-pyran-3-yl]carbonyl-benzoate
MOLECULAR FORMULA: C21H24O9
MOLECULAR WEIGHT: 420.40986
SMILES: CC(CC1=C(C(=O)C(=CO1)C(=O)C2=C(C=C(C=C2C(=O)OC)OC)OC)OC)OC
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Product OPENEYE NAME: 2-[3-[3-hydroxy-4-(4-hydroxyphenyl)-2,5-dimethoxy-phenyl]-5-oxo-2H-furan-2-yl]acetic acid
CAS Name: 2-[3-[3-hydroxy-4-(4-hydroxyphenyl)-2,5-dimethoxyphenyl]-5-oxo-2H-furan-2-yl]acetic acid
IUPAC NAME: 2-[3-[3-hydroxy-4-(4-hydroxyphenyl)-2,5-dimethoxyphenyl]-5-oxo-2H-furan-2-yl]acetic acid
SYSTEMATIC NAME: 2-[3-[4-(4-hydroxyphenyl)-2,5-dimethoxy-3-oxidanyl-phenyl]-5-oxidanylidene-2H-furan-2-yl]ethanoic acid
MOLECULAR FORMULA: C20H18O8
MOLECULAR WEIGHT: 386.35212
SMILES: COC1=C(C(=C(C(=C1)C2=CC(=O)OC2CC(=O)O)OC)O)C3=CC=C(C=C3)O
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Product OPENEYE NAME: 2-[3-hydroxy-7-(4-hydroxyphenyl)-6,9-dimethoxy-dibenzofuran-2-yl]oxy-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
CAS Name: 2-[[3-hydroxy-7-(4-hydroxyphenyl)-6,9-dimethoxy-2-dibenzofuranyl]oxy]-5-(hydroxymethyl)oxolane-3,4-diol
IUPAC NAME: 2-[3-hydroxy-7-(4-hydroxyphenyl)-6,9-dimethoxydibenzofuran-2-yl]oxy-5-(hydroxymethyl)oxolane-3,4-diol
SYSTEMATIC NAME: 2-(hydroxymethyl)-5-[7-(4-hydroxyphenyl)-6,9-dimethoxy-3-oxidanyl-dibenzofuran-2-yl]oxy-oxolane-3,4-diol
MOLECULAR FORMULA: C25H24O10
MOLECULAR WEIGHT: 484.45206
SMILES: COC1=C2C3=CC(=C(C=C3OC2=C(C(=C1)C4=CC=C(C=C4)O)OC)O)OC5C(C(C(O5)CO)O)O
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Product OPENEYE NAME: methyl (E)-5-hydroxy-4-[(2E,4E)-8-hydroxy-6-(hydroxymethyl)-4-methyl-octa-2,4-dienoyl]oxy-3-methoxy-6,8,10-trimethyl-dodec-10-enoate
CAS Name: (E)-5-hydroxy-4-[(2E,4E)-8-hydroxy-6-(hydroxymethyl)-4-methyl-1-oxoocta-2,4-dienoxy]-3-methoxy-6,8,10-trimethyl-10-dodecenoic acid methyl ester
IUPAC NAME: methyl (E)-5-hydroxy-4-[(2E,4E)-8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoyl]oxy-3-methoxy-6,8,10-trimethyldodec-10-enoate
SYSTEMATIC NAME: methyl (E)-4-[(2E,4E)-6-(hydroxymethyl)-4-methyl-8-oxidanyl-octa-2,4-dienoyl]oxy-3-methoxy-6,8,10-trimethyl-5-oxidanyl-dodec-10-enoate
MOLECULAR FORMULA: C27H46O8
MOLECULAR WEIGHT: 498.64934
SMILES: C/C=C(\C)/CC(C)CC(C)C(C(C(CC(=O)OC)OC)OC(=O)/C=C/C(=C/C(CCO)CO)/C)O
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Product OPENEYE NAME: [4-methoxy-6-oxo-2-[(E)-1,3,5-trimethylhept-5-enyl]tetrahydropyran-3-yl] (2E,4E)-8-hydroxy-6-(hydroxymethyl)-4-methyl-octa-2,4-dienoate
CAS Name: (2E,4E)-8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoic acid [2-[(E)-4,6-dimethyloct-6-en-2-yl]-4-methoxy-6-oxo-3-oxanyl] ester
IUPAC NAME: [2-[(E)-4,6-dimethyloct-6-en-2-yl]-4-methoxy-6-oxooxan-3-yl] (2E,4E)-8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoate
SYSTEMATIC NAME: [2-[(E)-4,6-dimethyloct-6-en-2-yl]-4-methoxy-6-oxidanylidene-oxan-3-yl] (2E,4E)-6-(hydroxymethyl)-4-methyl-8-oxidanyl-octa-2,4-dienoate
MOLECULAR FORMULA: C26H42O7
MOLECULAR WEIGHT: 466.60748
SMILES: C/C=C(\C)/CC(C)CC(C)C1C(C(CC(=O)O1)OC)OC(=O)/C=C/C(=C/C(CCO)CO)/C
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