(3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-3-[(2R)-3,3-dimethyloxiran-2-yl]-1-methyl-propyl]-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	DERVYtPxBUT
InChI	InChI=1S/C27H44O2/c1-17(6-11-24-25(2,3)29-24)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28H,6,8-16H2,1-5H3/t17-,19+,20+,21-,22+,23+,24-,26+,27-/m1/s1
InChIKey	OSENKJZWYQXHBN-PJXSLZQESA-N Google Search
Mol Weight	400.6 g/mol
Molecular Formula	C27H44O2
Exact Mass	400.334131 g/mol

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SpectraBase Spectrum ID	B43HKzWB7I0
Name	(3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-3-[(2R)-3,3-dimethyloxiran-2-yl]-1-methyl-propyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H44O2
InChI	InChI=1S/C27H44O2/c1-17(6-11-24-25(2,3)29-24)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28H,6,8-16H2,1-5H3/t17-,19+,20+,21-,22+,23+,24-,26+,27-/m1/s1
InChIKey	OSENKJZWYQXHBN-PJXSLZQESA-N
Molecular Weight	400.647 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@]1(OC1(C)C)[H])(C)[H])[H])[H])C)[H])C)[H]
SPLASH	splash10-0aor-4960000000-662c468ce5f9318c3807
Source of Spectrum	X3-59-25-2
Synonyms	(3S,8S,9S,10R,13R,14S,17R)-17-[(2R)-4-[(2R)-3,3-dimethyl-2-oxiranyl]butan-2-yl]-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-[(2R)-4-[(2R)-3,3-dimethyloxiran-2-yl]butan-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	1606157