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Androstane-3,7,12,17-tetrol, 7,12,17-triacetate, (3.alpha.,5.beta.,7.alpha.,12.alpha.,17.beta.)-
SpectraBase Compound ID 7Cde4R00scE
InChI InChI=1S/C25H38O7/c1-13(26)30-20-11-16-10-17(29)8-9-24(16,4)19-12-22(32-15(3)28)25(5)18(23(19)20)6-7-21(25)31-14(2)27/h16-23,29H,6-12H2,1-5H3
InChIKey KQVCGNQZEAYAMX-UHFFFAOYSA-N
Mol Weight 450.6 g/mol
Molecular Formula C25H38O7
Exact Mass 450.261754 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AF7XfvUqtuX
Name Androstane-3,7,12,17-tetrol, 7,12,17-triacetate, (3.alpha.,5.beta.,7.alpha.,12.alpha.,17.beta.)-
CAS Registry Number 64934-50-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H38O7
InChI InChI=1S/C25H38O7/c1-13(26)30-20-11-16-10-17(29)8-9-24(16,4)19-12-22(32-15(3)28)25(5)18(23(19)20)6-7-21(25)31-14(2)27/h16-23,29H,6-12H2,1-5H3
InChIKey KQVCGNQZEAYAMX-UHFFFAOYSA-N
Molecular Weight 450.572 g/mol
SMILES OC1CCC2(C(C1)CC(C1C2CC(C2(C1CCC2OC(=O)C)C)OC(=O)C)OC(=O)C)C
SPLASH splash10-0a70-0090200000-51dbd237759e7547c862
Source of Spectrum O-13-407-3
Synonyms 12,17-Bis(acetyloxy)-3-hydroxyandrostan-7-yl acetate (7,12-diacetoxy-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl) acetate (7,12-diacetyloxy-10,13-dimethyl-3-oxidanyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl) ethanoate (7,12-diacetyloxy-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl) acetate Acetic acid (7,12-diacetoxy-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl) ester Acetic acid (7,12-diacetyloxy-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl) ester
Wiley ID 1387709