(5R,8S,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-1-one oxime

SpectraBase Compound ID	GtpqtDLRFDb
InChI	InChI=1S/C27H47NO/c1-18(2)8-6-9-19(3)22-14-15-23-21-13-12-20-10-7-11-25(28-29)27(20,5)24(21)16-17-26(22,23)4/h18-24,29H,6-17H2,1-5H3/b28-25+/t19-,20-,21+,22-,23+,24+,26-,27+/m1/s1
InChIKey	QLRHBHJRNZTXMU-XYSGZWTBSA-N Google Search
Mol Weight	401.7 g/mol
Molecular Formula	C27H47NO
Exact Mass	401.365765 g/mol

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SpectraBase Spectrum ID	GWAwWCNO2hH
Name	(5R,8S,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-1-one oxime
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H47NO
InChI	InChI=1S/C27H47NO/c1-18(2)8-6-9-19(3)22-14-15-23-21-13-12-20-10-7-11-25(28-29)27(20,5)24(21)16-17-26(22,23)4/h18-24,29H,6-17H2,1-5H3/b28-25+/t19-,20-,21+,22-,23+,24+,26-,27+/m1/s1
InChIKey	QLRHBHJRNZTXMU-XYSGZWTBSA-N
Molecular Weight	401.679 g/mol
SMILES	O\N=C\1[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC[C@]2(CCC1)[H])[H])(CC[C@@]4([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H])C
SPLASH	splash10-0f79-2924800000-b9f35c6bdfdb0770a90e
Source of Spectrum	KC-22-2495-0
Synonyms	(5R,8S,9S,10S,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-1-one oxime (NE)-N-[(5R,8S,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-1-ylidene]hydroxylamine
Wiley ID	1370094