(3S,6E,8S,9S,10R,13R,14S,17R)-6-hydroxyimino-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ol

SpectraBase Compound ID	6vreXuivKOW
InChI	InChI=1S/C27H45NO2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(28-30)24-15-19(29)11-13-27(24,5)23(20)12-14-26(21,22)4/h15,17-23,29-30H,6-14,16H2,1-5H3/b28-25+/t18-,19+,20+,21-,22+,23+,26-,27-/m1/s1
InChIKey	GRMNIFYZNANARN-LHIOWLTKSA-N Google Search
Mol Weight	415.7 g/mol
Molecular Formula	C27H45NO2
Exact Mass	415.34503 g/mol

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SpectraBase Spectrum ID	KJkTabZ08RX
Name	(3S,6E,8S,9S,10R,13R,14S,17R)-6-hydroxyimino-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ol
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H45NO2
InChI	InChI=1S/C27H45NO2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(28-30)24-15-19(29)11-13-27(24,5)23(20)12-14-26(21,22)4/h15,17-23,29-30H,6-14,16H2,1-5H3/b28-25+/t18-,19+,20+,21-,22+,23+,26-,27-/m1/s1
InChIKey	GRMNIFYZNANARN-LHIOWLTKSA-N
Molecular Weight	415.662 g/mol
SMILES	O\N=C\1C=2[C@](CC[C@@](C2)(O)[H])([C@@]2([C@@](C1)([C@@]1(CC[C@@]([C@]1(CC2)C)([C@@](CCCC(C)C)(C)[H])[H])[H])[H])[H])C
SPLASH	splash10-0002-0009100000-2725d4dc1f49c06e0841
Source of Spectrum	F2-44-2616-7
Synonyms	(3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-3-hydroxy-10,13-dimethyl-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-6-one oxime (3S,8S,9S,10R,13R,14S,17R)-3-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-6-one oxime
Wiley ID	1639302