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(2R,3S,5R,10R,14R,15S)-2,3,11,14-Tetrahydroxy-10,13-dimethyl-17-((R)-1,2,5-trihydroxy-5-methyl-1-(R)-methyl-hexyl)-1,2,3,4,5,9,10,11,12,13,14,15,16,17-tetradecahydro-cyclopenta[a]phenanthren-6-
SpectraBase Compound ID HyMeq8TcIrg
InChI InChI=1S/C27H44O8/c1-23(2,33)8-7-21(32)26(5,34)20-6-9-27(35)15-11-16(28)14-10-17(29)18(30)12-24(14,3)22(15)19(31)13-25(20,27)4/h11,14,17-22,29-35H,6-10,12-13H2,1-5H3/t14-,17-,18+,19?,20?,21+,22?,24-,25+,26+,27+/m0/s1
InChIKey WSBAGDDNVWTLOM-PDMSRVCNSA-N
Mol Weight 496.6 g/mol
Molecular Formula C27H44O8
Exact Mass 496.303618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hhxgu4Ow9Ly
Name (2R,3S,5R,10R,14R,15S)-2,3,11,14-Tetrahydroxy-10,13-dimethyl-17-((R)-1,2,5-trihydroxy-5-methyl-1-(R)-methyl-hexyl)-1,2,3,4,5,9,10,11,12,13,14,15,16,17-tetradecahydro-cyclopenta[a]phenanthren-6-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H44O8
InChI InChI=1S/C27H44O8/c1-23(2,33)8-7-21(32)26(5,34)20-6-9-27(35)15-11-16(28)14-10-17(29)18(30)12-24(14,3)22(15)19(31)13-25(20,27)4/h11,14,17-22,29-35H,6-10,12-13H2,1-5H3/t14-,17-,18+,19?,20?,21+,22?,24-,25+,26+,27+/m0/s1
InChIKey WSBAGDDNVWTLOM-PDMSRVCNSA-N
Molecular Weight 496.641 g/mol
SMILES OC(CC[C@]([C@@](C1[C@@]2([C@@](CC1)(C1=CC([C@@]3(C[C@@]([C@@](C[C@@]3(C1C(C2)O)C)(O)[H])(O)[H])[H])=O)O)C)(O)C)(O)[H])(C)C
SPLASH splash10-0229-1009300000-fdc35d102b82b3fe5288
Source of Spectrum X3-35-182-1
Synonyms 5.beta..-Cholest-7-en-2.alpha.,3.alpha.,11.beta.,14.alpha.,20R,22R,25-heptahydroxy-6-one Lesterone one
Wiley ID 1691772