[(3R,7S,8S,9S,10S,11R,13R,14S,17R)-3,7-diacetoxy-11-hydroxy-13-methyl-17-vinyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-10-yl]methyl acetate

SpectraBase Compound ID	IvqKPCgPGUF
InChI	InChI=1S/C27H38O7/c1-6-18-7-8-21-24-23(34-17(4)30)12-19-11-20(33-16(3)29)9-10-27(19,14-32-15(2)28)25(24)22(31)13-26(18,21)5/h6,12,18,20-25,31H,1,7-11,13-14H2,2-5H3/t18-,20+,21-,22+,23+,24+,25-,26+,27+/m0/s1
InChIKey	YQQORHBTXYLWQF-XZGJBZQNSA-N Google Search
Mol Weight	474.6 g/mol
Molecular Formula	C27H38O7
Exact Mass	474.261754 g/mol

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SpectraBase Spectrum ID	F9oydC3xnfu
Name	[(3R,7S,8S,9S,10S,11R,13R,14S,17R)-3,7-diacetoxy-11-hydroxy-13-methyl-17-vinyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-10-yl]methyl acetate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H38O7
InChI	InChI=1S/C27H38O7/c1-6-18-7-8-21-24-23(34-17(4)30)12-19-11-20(33-16(3)29)9-10-27(19,14-32-15(2)28)25(24)22(31)13-26(18,21)5/h6,12,18,20-25,31H,1,7-11,13-14H2,2-5H3/t18-,20+,21-,22+,23+,24+,25-,26+,27+/m0/s1
InChIKey	YQQORHBTXYLWQF-XZGJBZQNSA-N
Molecular Weight	474.594 g/mol
SMILES	O[C@]1([C@@]2([C@@]3(C(=C[C@@](OC(=O)C)([C@]2([C@@]2(CC[C@@]([C@]2(C1)C)(C=C)[H])[H])[H])[H])C[C@](OC(=O)C)(CC3)[H])COC(=O)C)[H])[H]
SPLASH	splash10-01ox-2942000000-17ced53887809f70973f
Source of Spectrum	G4-60-576-7
Synonyms	[(3R,7S,8S,9S,10S,11R,13R,14S,17R)-3,7-diacetyloxy-17-ethenyl-11-hydroxy-13-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-10-yl]methyl acetate [(3R,7S,8S,9S,10S,11R,13R,14S,17R)-3,7-diacetyloxy-17-ethenyl-13-methyl-11-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-10-yl]methyl ethanoate Acetic acid [(3R,7S,8S,9S,10S,11R,13R,14S,17R)-3,7-diacetyloxy-17-ethenyl-11-hydroxy-13-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-10-yl]methyl ester
Wiley ID	1606724