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

SpectraBase Compound ID	Iw432diVriQ
InChI	InChI=1S/C29H48O/c1-7-8-21(19(2)3)17-20(4)25-11-12-26-24-10-9-22-18-23(30)13-15-28(22,5)27(24)14-16-29(25,26)6/h9,20,23-27,30H,7-8,10-18H2,1-6H3/t20-,23+,24+,25-,26+,27+,28+,29-/m1/s1
InChIKey	QIZZPXJUFDHERZ-VEVYEIKRSA-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	INvh7U6Nmy2
Name	(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-4-propan-2-ylideneheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Alternate Name(s)	(3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,4-dimethyl-3-propyl-pent-3-enyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol (3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-3-isopropylidene-1-methyl-hexyl]-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	96363-12-1
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C29H48O
InChI	InChI=1S/C29H48O/c1-7-8-21(19(2)3)17-20(4)25-11-12-26-24-10-9-22-18-23(30)13-15-28(22,5)27(24)14-16-29(25,26)6/h9,20,23-27,30H,7-8,10-18H2,1-6H3/t20-,23+,24+,25-,26+,27+,28+,29-/m1/s1
InChIKey	QIZZPXJUFDHERZ-VEVYEIKRSA-N
Molecular Weight	412.702 g/mol
SMILES	O[C@]1(CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC=C2C1)[H])(CC[C@@]4([C@@](CC(=C(C)C)CCC)(C)[H])[H])[H])C)[H])C)[H]
SPLASH	splash10-0udi-0094000000-49a99e1e0f8de866a6bd
Source of Spectrum	J-50-2030-18
Wiley ID	1374801