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(3S,5R,9S,10R,13R,14R,17R)-10,13-dimethyl-17-[(2R)-6-methylhept-5-en-2-yl]-4,5,6,9,11,12,14,15,16,17-decahydro-3H-cyclopenta[a]phenanthren-3-ol

View entire compound with spectra: 1 MS (GC)

(3S,5R,9S,10R,13R,14R,17R)-10,13-dimethyl-17-[(2R)-6-methylhept-5-en-2-yl]-4,5,6,9,11,12,14,15,16,17-decahydro-3H-cyclopenta[a]phenanthren-3-ol
SpectraBase Compound ID 7yowyW2CBok
InChI InChI=1S/C27H42O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h7,10,13,15,19-21,23-25,28H,6,8-9,11-12,14,16-17H2,1-5H3/t19-,20-,21-,23-,24+,25+,26+,27-/m1/s1
InChIKey RXFPCMMTAWMDKP-FZCGNDEKSA-N
Mol Weight 382.6 g/mol
Molecular Formula C27H42O
Exact Mass 382.323566 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4TSzyG78fCU
Name (3S,5R,9S,10R,13R,14R,17R)-10,13-dimethyl-17-[(2R)-6-methylhept-5-en-2-yl]-4,5,6,9,11,12,14,15,16,17-decahydro-3H-cyclopenta[a]phenanthren-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H42O
InChI InChI=1S/C27H42O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h7,10,13,15,19-21,23-25,28H,6,8-9,11-12,14,16-17H2,1-5H3/t19-,20-,21-,23-,24+,25+,26+,27-/m1/s1
InChIKey RXFPCMMTAWMDKP-FZCGNDEKSA-N
Molecular Weight 382.632 g/mol
SMILES O[C@]1(C[C@]2(CC=C3[C@]4([C@]([C@@]([C@@](CCC=C(C)C)(C)[H])(CC4)[H])(C)CC[C@@]3([C@]2(C=C1)C)[H])[H])[H])[H]
SPLASH splash10-03di-0049000000-d6a4883c1ef96abf8e18
Source of Spectrum F-49-2495-22
Synonyms (3S,5R,9S,10R,13R,14R,17R)-17-[(1R)-1,5-dimethylhex-4-enyl]-10,13-dimethyl-4,5,6,9,11,12,14,15,16,17-decahydro-3H-cyclopenta[a]phenanthren-3-ol
Wiley ID 1360909