(3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-2-[(1R,3R)-3-ethyl-2,2-dimethyl-cyclopropyl]-1-methyl-ethyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

SpectraBase Compound ID	5StHJTWCXpv
InChI	InChI=1S/C29H48O/c1-7-22-26(27(22,3)4)16-18(2)23-10-11-24-21-9-8-19-17-20(30)12-14-28(19,5)25(21)13-15-29(23,24)6/h8,18,20-26,30H,7,9-17H2,1-6H3/t18-,20+,21+,22-,23-,24+,25+,26-,28+,29-/m1/s1
InChIKey	HRNVWBIKQMSFHI-GFECEOJFSA-N Google Search
Mol Weight	412.7 g/mol
Molecular Formula	C29H48O
Exact Mass	412.370516 g/mol

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SpectraBase Spectrum ID	7c5nDyJ1Kgn
Name	(3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-2-[(1R,3R)-3-ethyl-2,2-dimethyl-cyclopropyl]-1-methyl-ethyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
CAS Registry Number	96442-67-0
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C29H48O
InChI	InChI=1S/C29H48O/c1-7-22-26(27(22,3)4)16-18(2)23-10-11-24-21-9-8-19-17-20(30)12-14-28(19,5)25(21)13-15-29(23,24)6/h8,18,20-26,30H,7,9-17H2,1-6H3/t18-,20+,21+,22-,23-,24+,25+,26-,28+,29-/m1/s1
InChIKey	HRNVWBIKQMSFHI-GFECEOJFSA-N
Molecular Weight	412.702 g/mol
SMILES	O[C@]1(CC[C@@]2([C@]3(CC[C@@]4([C@@]([C@@](C[C@]5(C(C)(C)[C@@]5(CC)[H])[H])(C)[H])(CC[C@]4([C@@]3(CC=C2C1)[H])[H])[H])C)[H])C)[H]
SPLASH	splash10-0002-7092000000-f19f292ebf0e2dd6cdf0
Source of Spectrum	J-50-2030-7
Synonyms	(3S,8S,9S,10R,13R,14S,17R)-17-[(2R)-1-[(1R,3R)-3-ethyl-2,2-dimethyl-cyclopropyl]propan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Wiley ID	1374799