Product OPENEYE NAME: (Z)-[amino(hydroxy)methylene]-tridecylsulfanyl-ammonium
CAS Name: (Z)-[amino(hydroxy)methylidene]-(tridecylthio)ammonium
IUPAC NAME: (Z)-[amino(hydroxy)methylidene]-tridecylsulfanylazanium
SYSTEMATIC NAME: (Z)-[azanyl(oxidanyl)methylidene]-tridecylsulfanyl-azanium
MOLECULAR FORMULA: C14H31N2OS+
MOLECULAR WEIGHT: 275.47374
SMILES: CCCCCCCCCCCCCS/[NH+]=C(/N)\O
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Product OPENEYE NAME: tridecylsulfanylurea
CAS Name: (tridecylthio)urea
IUPAC NAME: tridecylsulfanylurea
SYSTEMATIC NAME: 1-tridecylsulfanylurea
MOLECULAR FORMULA: C14H30N2OS
MOLECULAR WEIGHT: 274.4658
SMILES: CCCCCCCCCCCCCSNC(=O)N
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Product OPENEYE NAME: 2-aminoacetic acid tetrahydrate
CAS Name: 2-aminoacetic acid tetrahydrate
IUPAC NAME: 2-aminoacetic acid tetrahydrate
SYSTEMATIC NAME: 2-azanylethanoic acid tetrahydrate
MOLECULAR FORMULA: C2H13NO6
MOLECULAR WEIGHT: 147.12772
SMILES: C(C(=O)O)N.O.O.O.O
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Product OPENEYE NAME: N1,N4-bis[4-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]sulfanylphenyl]terephthalamide
CAS Name: N1,N4-bis[4-[[3,4-dihydroxy-6-(hydroxymethyl)-5-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-oxanyl]thio]phenyl]benzene-1,4-dicarboxamide
IUPAC NAME: 1-N,4-N-bis[4-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]sulfanylphenyl]benzene-1,4-dicarboxamide
SYSTEMATIC NAME: N1,N4-bis[4-[6-(hydroxymethyl)-5-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3,4-bis(oxidanyl)oxan-2-yl]sulfanylphenyl]benzene-1,4-dicarboxamide
MOLECULAR FORMULA: C44H56N2O22S2
MOLECULAR WEIGHT: 1029.04564
SMILES: C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)SC3C(C(C(C(O3)CO)OC4C(C(C(C(O4)CO)O)O)O)O)O)C(=O)NC5=CC=C(C=C5)SC6C(C(C(C(O6)CO)OC7C(C(C(C(O7)CO)O)O)O)O)O
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Product OPENEYE NAME: N1,N3,N3-tris[4-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]sulfanylphenyl]benzene-1,3,5-tricarboxamide
CAS Name: N1,N3,N3-tris[4-[[3,4-dihydroxy-6-(hydroxymethyl)-5-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-oxanyl]thio]phenyl]benzene-1,3,5-tricarboxamide
IUPAC NAME: 1-N,3-N,3-N-tris[4-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]sulfanylphenyl]benzene-1,3,5-tricarboxamide
SYSTEMATIC NAME: N1,N3,N3-tris[4-[6-(hydroxymethyl)-5-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3,4-bis(oxidanyl)oxan-2-yl]sulfanylphenyl]benzene-1,3,5-tricarboxamide
MOLECULAR FORMULA: C63H81N3O33S3
MOLECULAR WEIGHT: 1504.51254
SMILES: C1=CC(=CC=C1NC(=O)C2=CC(=CC(=C2)C(=O)N)C(=O)N(C3=CC=C(C=C3)SC4C(C(C(C(O4)CO)OC5C(C(C(C(O5)CO)O)O)O)O)O)C6=CC=C(C=C6)SC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)O)O)O)O)SC9C(C(C(C(O9)CO)OC1C(C(C(C(O1)CO)O)O)O)O)O
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Product OPENEYE NAME: tetradecasodium [2-[6-[4-[[4-[[4-[3,4-disulfooxy-6-(sulfooxymethyl)-5-[3,4,5-trisulfooxy-6-(sulfooxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]sulfanylphenyl]carbamoyl]benzoyl]amino]phenyl]sulfanyl-4,5-disulfooxy-2-(sulfooxymethyl)tetrahydropyra
CAS Name: tetradecasodium sulfuric acid [2-[[6-[[4-[[[4-[[4-[[3,4-disulfooxy-6-(sulfooxymethyl)-5-[[3,4,5-trisulfooxy-6-(sulfooxymethyl)-2-oxanyl]oxy]-2-oxanyl]thio]anilino]-oxomethyl]phenyl]-oxomethyl]amino]phenyl]thio]-4,5-disulfooxy-2-(sulfooxymethyl)-3-oxanyl]o
IUPAC NAME: tetradecasodium [2-[6-[4-[[4-[[4-[3,4-disulfooxy-6-(sulfooxymethyl)-5-[3,4,5-trisulfooxy-6-(sulfooxymethyl)oxan-2-yl]oxyoxan-2-yl]sulfanylphenyl]carbamoyl]benzoyl]amino]phenyl]sulfanyl-4,5-disulfooxy-2-(sulfooxymethyl)oxan-3-yl]oxy-3,5-disulfooxy-6-(sulfo
SYSTEMATIC NAME: tetradecasodium [2-[6-[4-[[4-[[4-[3,4-disulfooxy-6-(sulfooxymethyl)-5-[3,4,5-trisulfooxy-6-(sulfooxymethyl)oxan-2-yl]oxy-oxan-2-yl]sulfanylphenyl]carbamoyl]phenyl]carbonylamino]phenyl]sulfanyl-4,5-disulfooxy-2-(sulfooxymethyl)oxan-3-yl]oxy-3,5-disulfooxy-
MOLECULAR FORMULA: C44H56N2Na14O64S16+14
MOLECULAR WEIGHT: 2471.78722
SMILES: C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)SC3C(C(C(C(O3)COS(=O)(=O)O)OC4C(C(C(C(O4)COS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)C(=O)NC5=CC=C(C=C5)SC6C(C(C(C(O6)COS(=O)(=O)O)OC7C(C(C(C(O7)COS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)O
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Product OPENEYE NAME: [2-[6-[4-[[4-[[4-[3,4-disulfooxy-6-(sulfooxymethyl)-5-[3,4,5-trisulfooxy-6-(sulfooxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]sulfanylphenyl]carbamoyl]benzoyl]amino]phenyl]sulfanyl-4,5-disulfooxy-2-(sulfooxymethyl)tetrahydropyran-3-yl]oxy-3,5-d
CAS Name: sulfuric acid [2-[[6-[[4-[[[4-[[4-[[3,4-disulfooxy-6-(sulfooxymethyl)-5-[[3,4,5-trisulfooxy-6-(sulfooxymethyl)-2-oxanyl]oxy]-2-oxanyl]thio]anilino]-oxomethyl]phenyl]-oxomethyl]amino]phenyl]thio]-4,5-disulfooxy-2-(sulfooxymethyl)-3-oxanyl]oxy]-3,5-disulfoo
IUPAC NAME: [2-[6-[4-[[4-[[4-[3,4-disulfooxy-6-(sulfooxymethyl)-5-[3,4,5-trisulfooxy-6-(sulfooxymethyl)oxan-2-yl]oxyoxan-2-yl]sulfanylphenyl]carbamoyl]benzoyl]amino]phenyl]sulfanyl-4,5-disulfooxy-2-(sulfooxymethyl)oxan-3-yl]oxy-3,5-disulfooxy-6-(sulfooxymethyl)oxan-4
SYSTEMATIC NAME: [2-[6-[4-[[4-[[4-[3,4-disulfooxy-6-(sulfooxymethyl)-5-[3,4,5-trisulfooxy-6-(sulfooxymethyl)oxan-2-yl]oxy-oxan-2-yl]sulfanylphenyl]carbamoyl]phenyl]carbonylamino]phenyl]sulfanyl-4,5-disulfooxy-2-(sulfooxymethyl)oxan-3-yl]oxy-3,5-disulfooxy-6-(sulfooxymethy
MOLECULAR FORMULA: C44H56N2O64S16
MOLECULAR WEIGHT: 2149.93044
SMILES: C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)SC3C(C(C(C(O3)COS(=O)(=O)O)OC4C(C(C(C(O4)COS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)C(=O)NC5=CC=C(C=C5)SC6C(C(C(C(O6)COS(=O)(=O)O)OC7C(C(C(C(O7)COS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)O
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Product OPENEYE NAME: sodium 4-aminobenzenethiol
CAS Name: sodium 4-aminobenzenethiol
IUPAC NAME: sodium 4-aminobenzenethiol
SYSTEMATIC NAME: sodium 4-azanylbenzenethiol
MOLECULAR FORMULA: C6H7NNaS+
MOLECULAR WEIGHT: 148.18125
SMILES: C1=CC(=CC=C1N)S.[Na+]
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Product OPENEYE NAME: [2-[6-[4-[[3-[bis[4-[3,4-disulfooxy-6-(sulfooxymethyl)-5-[3,4,5-trisulfooxy-6-(sulfooxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]sulfanylphenyl]sulfamoyl]-5-sulfamoyl-phenyl]sulfonylamino]phenyl]sulfanyl-4,5-disulfooxy-2-(sulfooxymethyl)tetrahy
CAS Name: sulfuric acid [2-[[6-[[4-[[3-[bis[4-[[3,4-disulfooxy-6-(sulfooxymethyl)-5-[[3,4,5-trisulfooxy-6-(sulfooxymethyl)-2-oxanyl]oxy]-2-oxanyl]thio]phenyl]sulfamoyl]-5-sulfamoylphenyl]sulfonylamino]phenyl]thio]-4,5-disulfooxy-2-(sulfooxymethyl)-3-oxanyl]oxy]-3,5
IUPAC NAME: [2-[6-[4-[[3-[bis[4-[3,4-disulfooxy-6-(sulfooxymethyl)-5-[3,4,5-trisulfooxy-6-(sulfooxymethyl)oxan-2-yl]oxyoxan-2-yl]sulfanylphenyl]sulfamoyl]-5-sulfamoylphenyl]sulfonylamino]phenyl]sulfanyl-4,5-disulfooxy-2-(sulfooxymethyl)oxan-3-yl]oxy-3,5-disulfooxy-6-
SYSTEMATIC NAME: [2-[6-[4-[[3-[bis[4-[3,4-disulfooxy-6-(sulfooxymethyl)-5-[3,4,5-trisulfooxy-6-(sulfooxymethyl)oxan-2-yl]oxy-oxan-2-yl]sulfanylphenyl]sulfamoyl]-5-sulfamoyl-phenyl]sulfonylamino]phenyl]sulfanyl-4,5-disulfooxy-2-(sulfooxymethyl)oxan-3-yl]oxy-3,5-disulfooxy-
MOLECULAR FORMULA: C60H81N3O99S27
MOLECULAR WEIGHT: 3294.00084
SMILES: C1=CC(=CC=C1NS(=O)(=O)C2=CC(=CC(=C2)S(=O)(=O)N)S(=O)(=O)N(C3=CC=C(C=C3)SC4C(C(C(C(O4)COS(=O)(=O)O)OC5C(C(C(C(O5)COS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)C6=CC=C(C=C6)SC7C(C(C(C(O7)COS(=O)(=O)O)OC8C(C(C(C(O8)COS(=O)(=O)O)OS(
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C105H123N3O54S3
MOLECULAR WEIGHT: 2387.28282
SMILES: CC(=O)OCC1C(C(C(C(O1)OC2C(OC(C(C2OC(=O)C)OC(=O)C)SC3=CC=C(C=C3)NC(=O)C4=CC(=CC(=C4)C(=O)N)C(=O)N(C5=CC=C(C=C5)SC6C(C(C(C(O6)COC(=O)C)OC7C(C(C(C(O7)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C8=CC=C(C=C8)SC9C(C(C(C(O9)COC(=O)C)OC1C(C(C(C(O1)COC(=O)C)
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Product OPENEYE NAME: [3,4,5-triacetoxy-6-[4,5-diacetoxy-2-(acetoxymethyl)-6-[4-[[4-[[4-[3,4-diacetoxy-6-(acetoxymethyl)-5-[3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]sulfanylphenyl]carbamoyl]benzoyl]amino]phenyl]sulfanyl-tetrahydropyran-3-
CAS Name: acetic acid [3,4,5-triacetyloxy-6-[[4,5-diacetyloxy-2-(acetyloxymethyl)-6-[[4-[[[4-[[4-[[3,4-diacetyloxy-6-(acetyloxymethyl)-5-[[3,4,5-triacetyloxy-6-(acetyloxymethyl)-2-oxanyl]oxy]-2-oxanyl]thio]anilino]-oxomethyl]phenyl]-oxomethyl]amino]phenyl]thio]-3-o
IUPAC NAME: [3,4,5-triacetyloxy-6-[4,5-diacetyloxy-2-(acetyloxymethyl)-6-[4-[[4-[[4-[3,4-diacetyloxy-6-(acetyloxymethyl)-5-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]sulfanylphenyl]carbamoyl]benzoyl]amino]phenyl]sulfanyloxan-3-yl]oxyoxan-2-yl]methy
SYSTEMATIC NAME: [3,4,5-triacetyloxy-6-[4,5-diacetyloxy-2-(acetyloxymethyl)-6-[4-[[4-[[4-[3,4-diacetyloxy-6-(acetyloxymethyl)-5-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-oxan-2-yl]sulfanylphenyl]carbamoyl]phenyl]carbonylamino]phenyl]sulfanyl-oxan-3-yl]oxy-oxan-
MOLECULAR FORMULA: C72H84N2O36S2
MOLECULAR WEIGHT: 1617.55916
SMILES: CC(=O)OCC1C(C(C(C(O1)OC2C(OC(C(C2OC(=O)C)OC(=O)C)SC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)C(=O)NC5=CC=C(C=C5)SC6C(C(C(C(O6)COC(=O)C)OC7C(C(C(C(O7)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
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Product OPENEYE NAME: [2-(1-acetoxy-1-acetyl-2-oxo-propyl)-2,3,4-triacetyl-4-bromooxy-5-hydroxy-6-[4,5,6-trihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-tetrahydropyran-3-yl] acetate
CAS Name: acetic acid [2,3,4-triacetyl-2-(3-acetyloxy-2,4-dioxopentan-3-yl)-4-bromooxy-5-hydroxy-6-[[4,5,6-trihydroxy-2-(hydroxymethyl)-3-oxanyl]oxy]-3-oxanyl] ester
IUPAC NAME: [2,3,4-triacetyl-2-(3-acetyloxy-2,4-dioxopentan-3-yl)-4-bromooxy-5-hydroxy-6-[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl] acetate
SYSTEMATIC NAME: [2-[3-acetyloxy-2,4-bis(oxidanylidene)pentan-3-yl]-4-bromanyloxy-2,3,4-triethanoyl-6-[2-(hydroxymethyl)-4,5,6-tris(oxidanyl)oxan-3-yl]oxy-5-oxidanyl-oxan-3-yl] ethanoate
MOLECULAR FORMULA: C26H35BrO18
MOLECULAR WEIGHT: 715.4493
SMILES: CC(=O)C1(C(C(OC(C1(C(=O)C)OC(=O)C)(C(=O)C)C(C(=O)C)(C(=O)C)OC(=O)C)OC2C(OC(C(C2O)O)O)CO)O)OBr
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Product OPENEYE NAME: N1,N3,N3-tris[4-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]sulfanylphenyl]benzene-1,3,5-trisulfonamide
CAS Name: N1,N3,N3-tris[4-[[3,4-dihydroxy-6-(hydroxymethyl)-5-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-oxanyl]thio]phenyl]benzene-1,3,5-trisulfonamide
IUPAC NAME: 1-N,3-N,3-N-tris[4-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]sulfanylphenyl]benzene-1,3,5-trisulfonamide
SYSTEMATIC NAME: N1,N3,N3-tris[4-[6-(hydroxymethyl)-5-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3,4-bis(oxidanyl)oxan-2-yl]sulfanylphenyl]benzene-1,3,5-trisulfonamide
MOLECULAR FORMULA: C60H81N3O36S6
MOLECULAR WEIGHT: 1612.67364
SMILES: C1=CC(=CC=C1NS(=O)(=O)C2=CC(=CC(=C2)S(=O)(=O)N)S(=O)(=O)N(C3=CC=C(C=C3)SC4C(C(C(C(O4)CO)OC5C(C(C(C(O5)CO)O)O)O)O)O)C6=CC=C(C=C6)SC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)O)O)O)O)SC9C(C(C(C(O9)CO)OC1C(C(C(C(O1)CO)O)O)O)O)O
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Product OPENEYE NAME: [2-[6-[4-[[4-[[4-[3,4-disulfonatooxy-6-(sulfonatooxymethyl)-5-[3,4,5-trisulfonatooxy-6-(sulfonatooxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]sulfanylphenyl]carbamoyl]benzoyl]amino]phenyl]sulfanyl-4,5-disulfonatooxy-2-(sulfonatooxymethyl)tetrah
CAS Name: [2-[[6-[[4-[[[4-[[4-[[3,4-disulfonatooxy-6-(sulfonatooxymethyl)-5-[[3,4,5-trisulfonatooxy-6-(sulfonatooxymethyl)-2-oxanyl]oxy]-2-oxanyl]thio]anilino]-oxomethyl]phenyl]-oxomethyl]amino]phenyl]thio]-4,5-disulfonatooxy-2-(sulfonatooxymethyl)-3-oxanyl]oxy]-3,
IUPAC NAME: [2-[6-[4-[[4-[[4-[3,4-disulfonatooxy-6-(sulfonatooxymethyl)-5-[3,4,5-trisulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxyoxan-2-yl]sulfanylphenyl]carbamoyl]benzoyl]amino]phenyl]sulfanyl-4,5-disulfonatooxy-2-(sulfonatooxymethyl)oxan-3-yl]oxy-3,5-disulfonato
SYSTEMATIC NAME: [2-[6-[4-[[4-[[4-[3,4-disulfonatooxy-6-(sulfonatooxymethyl)-5-[3,4,5-trisulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-oxan-2-yl]sulfanylphenyl]carbamoyl]phenyl]carbonylamino]phenyl]sulfanyl-4,5-disulfonatooxy-2-(sulfonatooxymethyl)oxan-3-yl]oxy-3,5-dis
MOLECULAR FORMULA: C128H266N16O64S16
MOLECULAR WEIGHT: 3566.59044
SMILES: CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)SC3C(C(C(C(O3)COS(=O)(=O)[O-
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CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C102H123N3O57S6
MOLECULAR WEIGHT: 2495.44392
SMILES: CC(=O)OCC1C(C(C(C(O1)OC2C(OC(C(C2OC(=O)C)OC(=O)C)SC3=CC=C(C=C3)NS(=O)(=O)C4=CC(=CC(=C4)S(=O)(=O)N)S(=O)(=O)N(C5=CC=C(C=C5)SC6C(C(C(C(O6)COC(=O)C)OC7C(C(C(C(O7)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C8=CC=C(C=C8)SC9C(C(C(C(O9)COC(=O)C)OC1C(C(C(C(
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Product OPENEYE NAME: [2-[6-[4-[[3-[bis[4-[3,4-disulfooxy-6-(sulfooxymethyl)-5-[3,4,5-trisulfooxy-6-(sulfooxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]sulfanylphenyl]carbamoyl]-5-carbamoyl-benzoyl]amino]phenyl]sulfanyl-4,5-disulfooxy-2-(sulfooxymethyl)tetrahydropyra
CAS Name: sulfuric acid [2-[[6-[[4-[N-[[3-carbamoyl-5-[[4-[[3,4-disulfooxy-6-(sulfooxymethyl)-5-[[3,4,5-trisulfooxy-6-(sulfooxymethyl)-2-oxanyl]oxy]-2-oxanyl]thio]anilino]-oxomethyl]phenyl]-oxomethyl]-4-[[3,4-disulfooxy-6-(sulfooxymethyl)-5-[[3,4,5-trisulfooxy-6-(s
IUPAC NAME: [2-[6-[4-[[3-[bis[4-[3,4-disulfooxy-6-(sulfooxymethyl)-5-[3,4,5-trisulfooxy-6-(sulfooxymethyl)oxan-2-yl]oxyoxan-2-yl]sulfanylphenyl]carbamoyl]-5-carbamoylbenzoyl]amino]phenyl]sulfanyl-4,5-disulfooxy-2-(sulfooxymethyl)oxan-3-yl]oxy-3,5-disulfooxy-6-(sulfoo
SYSTEMATIC NAME: [2-[6-[4-[[3-aminocarbonyl-5-[bis[4-[3,4-disulfooxy-6-(sulfooxymethyl)-5-[3,4,5-trisulfooxy-6-(sulfooxymethyl)oxan-2-yl]oxy-oxan-2-yl]sulfanylphenyl]carbamoyl]phenyl]carbonylamino]phenyl]sulfanyl-4,5-disulfooxy-2-(sulfooxymethyl)oxan-3-yl]oxy-3,5-disulfoo
MOLECULAR FORMULA: C63H81N3O96S24
MOLECULAR WEIGHT: 3185.83974
SMILES: C1=CC(=CC=C1NC(=O)C2=CC(=CC(=C2)C(=O)N)C(=O)N(C3=CC=C(C=C3)SC4C(C(C(C(O4)COS(=O)(=O)O)OC5C(C(C(C(O5)COS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)C6=CC=C(C=C6)SC7C(C(C(C(O7)COS(=O)(=O)O)OC8C(C(C(C(O8)COS(=O)(=O)O)OS(=O)(=O)O)OS(
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Product OPENEYE NAME: [17-(2-acetoxyacetyl)-11-hydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] 2-methoxyacetate
CAS Name: 2-methoxyacetic acid [17-(2-acetyloxy-1-oxoethyl)-11-hydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] ester
IUPAC NAME: [17-(2-acetyloxyacetyl)-11-hydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] 2-methoxyacetate
SYSTEMATIC NAME: [17-(2-acetyloxyethanoyl)-10,13-dimethyl-11-oxidanyl-3-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] 2-methoxyethanoate
MOLECULAR FORMULA: C26H34O8
MOLECULAR WEIGHT: 474.54336
SMILES: CC(=O)OCC(=O)C1(CCC2C1(CC(C3C2CCC4=CC(=O)C=CC34C)O)C)OC(=O)COC
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