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Cholest-2-eno[2,3-b]azet-3(2H)-ol, 1',4'-dihydro-1'-phenyl-, (5.alpha.)-
SpectraBase Compound ID 4LGemx8t2gD
InChI InChI=1S/C34H53NO/c1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-25-21-34(36)26(22-35(34)27-12-7-6-8-13-27)20-33(25,5)31(28)18-19-32(29,30)4/h6-8,12-13,23-26,28-31,36H,9-11,14-22H2,1-5H3/t24-,25+,26?,28?,29-,30+,31?,32-,33+,34?/m1/s1
InChIKey PUWWFMDAJPWOTN-WSVNJFOQSA-N
Mol Weight 491.8 g/mol
Molecular Formula C34H53NO
Exact Mass 491.412715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Elw4R3ujfUy
Name Cholest-2-eno[2,3-b]azet-3(2H)-ol, 1',4'-dihydro-1'-phenyl-, (5.alpha.)-
Alternate Name(s) (1R,3aS,5aS,9aS,11aR)-1-[(1R)-1,5-dimethylhexyl]-9a,11a-dimethyl-7-phenyloctadecahydro-6aH-cyclopenta[7,8]phenanthro[2,3-b]azet-6a-ol 1H-cyclopenta[7,8]phenanthro[3,2-b]azete, cholest-2-eno[2,3-b]azet-3(2H)-ol deriv. Cholestano-phenylazetidinol
CAS Registry Number 38257-51-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H53NO
InChI InChI=1S/C34H53NO/c1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-25-21-34(36)26(22-35(34)27-12-7-6-8-13-27)20-33(25,5)31(28)18-19-32(29,30)4/h6-8,12-13,23-26,28-31,36H,9-11,14-22H2,1-5H3/t24-,25+,26?,28?,29-,30+,31?,32-,33+,34?/m1/s1
InChIKey PUWWFMDAJPWOTN-WSVNJFOQSA-N
Molecular Weight 491.804 g/mol
SMILES OC12N(c3ccccc3)CC1C[C@]1([C@](C2)(CCC2[C@]3([C@]([C@]([C@@](CCCC(C)C)(C)[H])([H])CC3)(C)CCC12)[H])[H])C
SPLASH splash10-0a5j-9700000000-609722b15d221d720f4f
Source of Spectrum KC-1983-579-0
Wiley ID 1397436