(3R,5S,7R,8R,9S,10S,13R,14S,17R)-17-[(1R)-3-(2-imidazolin-2-yl)-1-methyl-propyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

SpectraBase Compound ID	7f5E1tTNqlQ
InChI	InChI=1S/C26H44N2O2/c1-16(4-7-23-27-12-13-28-23)19-5-6-20-24-21(9-11-26(19,20)3)25(2)10-8-18(29)14-17(25)15-22(24)30/h16-22,24,29-30H,4-15H2,1-3H3,(H,27,28)/t16-,17+,18-,19-,20+,21+,22-,24+,25+,26-/m1/s1
InChIKey	DAXBTXDFKFXYMB-BJLOMENOSA-N Google Search
Mol Weight	416.7 g/mol
Molecular Formula	C26H44N2O2
Exact Mass	416.340279 g/mol

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SpectraBase Spectrum ID	Dzvt6YT6384
Name	(3R,5S,7R,8R,9S,10S,13R,14S,17R)-17-[(1R)-3-(2-imidazolin-2-yl)-1-methyl-propyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C26H44N2O2
InChI	InChI=1S/C26H44N2O2/c1-16(4-7-23-27-12-13-28-23)19-5-6-20-24-21(9-11-26(19,20)3)25(2)10-8-18(29)14-17(25)15-22(24)30/h16-22,24,29-30H,4-15H2,1-3H3,(H,27,28)/t16-,17+,18-,19-,20+,21+,22-,24+,25+,26-/m1/s1
InChIKey	DAXBTXDFKFXYMB-BJLOMENOSA-N
Molecular Weight	416.650 g/mol
SMILES	O[C@@]1(CC[C@]2([C@](C[C@]([C@]3([C@]4([C@@]([C@@]([C@@](CCC5=NCCN5)(C)[H])(CC4)[H])(CC[C@]23[H])C)[H])[H])(O)[H])(C1)[H])C)[H]
SPLASH	splash10-000t-9000000000-1d2e20a15ccdc135a5d5
Source of Spectrum	G-62-476-4
Synonyms	(3R,5S,7R,8R,9S,10S,13R,14S,17R)-17-[(1R)-3-(4,5-dihydro-1H-imidazol-2-yl)-1-methyl-propyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol (3R,5S,7R,8R,9S,10S,13R,14S,17R)-17-[(2R)-4-(4,5-dihydro-1H-imidazol-2-yl)butan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
Wiley ID	749251