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(20R)-17-azachol-5-en-3.beta.-ol (17-azacholesterol)
SpectraBase Compound ID 2aSV701Vrb
InChI InChI=1S/C26H45NO/c1-18(2)7-6-8-19(3)27-16-13-24-22-10-9-20-17-21(28)11-14-25(20,4)23(22)12-15-26(24,27)5/h9,18-19,21-24,28H,6-8,10-17H2,1-5H3/t19-,21+,22?,23?,24?,25+,26+/m1/s1
InChIKey HJDNWJNXAHIXMN-JUWPOCQDSA-N
Mol Weight 387.7 g/mol
Molecular Formula C26H45NO
Exact Mass 387.350115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Awj1mDBNtpp
Name (20R)-17-azachol-5-en-3.beta.-ol (17-azacholesterol)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H45NO
InChI InChI=1S/C26H45NO/c1-18(2)7-6-8-19(3)27-16-13-24-22-10-9-20-17-21(28)11-14-25(20,4)23(22)12-15-26(24,27)5/h9,18-19,21-24,28H,6-8,10-17H2,1-5H3/t19-,21+,22?,23?,24?,25+,26+/m1/s1
InChIKey HJDNWJNXAHIXMN-JUWPOCQDSA-N
Molecular Weight 387.652 g/mol
SMILES O[C@]1(CC[C@@]2(C3CC[C@@]4(N(CCC4C3CC=C2C1)[C@@](CCCC(C)C)(C)[H])C)C)[H]
SPLASH splash10-0fk9-0009000000-b42c3eb6c3ed73a0d99c
Source of Spectrum H1-41-936-6
Synonyms (7S,9aR,11aS)-1-[(1R)-1,5-dimethylhexyl]-9a,11a-dimethyl-2,3,3a,3b,4,6,7,8,9,9a,9b,10,11,11a-tetradecahydro-1H-naphtho[2,1-e]indol-7-ol
Wiley ID 757197