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17.beta.-[(Guanidinoamino)methyl-5.beta.-androstane-3.beta.,14.beta.-diol Hydrochloride
SpectraBase Compound ID BewUVaHolWW
InChI InChI=1S/C21H38N4O2/c1-19-8-6-15(26)11-13(19)3-4-17-16(19)7-9-20(2)14(5-10-21(17,20)27)12-24-25-18(22)23/h13-17,24,26-27H,3-12H2,1-2H3,(H4,22,23,25)/t13-,14-,15+,16?,17?,19+,20-,21+/m1/s1
InChIKey TUOKAPUNXQTTDK-KRGKVNQNSA-N
Mol Weight 378.6 g/mol
Molecular Formula C21H38N4O2
Exact Mass 378.299476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2z2HqAY3XHx
Name 17.beta.-[(Guanidinoamino)methyl-5.beta.-androstane-3.beta.,14.beta.-diol Hydrochloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H38N4O2
InChI InChI=1S/C21H38N4O2/c1-19-8-6-15(26)11-13(19)3-4-17-16(19)7-9-20(2)14(5-10-21(17,20)27)12-24-25-18(22)23/h13-17,24,26-27H,3-12H2,1-2H3,(H4,22,23,25)/t13-,14-,15+,16?,17?,19+,20-,21+/m1/s1
InChIKey TUOKAPUNXQTTDK-KRGKVNQNSA-N
Molecular Weight 378.561 g/mol
SMILES O[C@]1(CC[C@@]2(C3CC[C@]4([C@@](C3CC[C@@]2(C1)[H])(CC[C@@]4(CNN=C(N)N)[H])O)C)C)[H]
SPLASH splash10-000i-9001000000-96d6d345d479ca9ebdf5
Source of Spectrum F2-40-3487-4
Synonyms 2-[[(3S,5R,10S,13R,14S,17S)-10,13-dimethyl-3,14-bis(oxidanyl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]methylamino]guanidine
Wiley ID 1599381