For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4.beta.-hydroxyverazine

View entire compound with spectra: 1 MS (GC)

4.beta.-hydroxyverazine
SpectraBase Compound ID BFEK17TdR85
InChI InChI=1S/C27H43NO2/c1-16-5-10-23(28-15-16)17(2)19-8-9-20-18-6-7-22-25(30)24(29)12-14-27(22,4)21(18)11-13-26(19,20)3/h7,16-21,24-25,29-30H,5-6,8-15H2,1-4H3/t16-,17-,18-,19+,20-,21-,24-,25+,26+,27+/m0/s1
InChIKey BLVNKXGGFFUMSS-CGYGGFEXSA-N
Mol Weight 413.6 g/mol
Molecular Formula C27H43NO2
Exact Mass 413.32938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID I1QIahDqvvg
Name 4.beta.-hydroxyverazine
Alternate Name(s) (20S)-22,26-Iminocholesta-5,22-diene-3,4-diol (3beta,4beta,20S)-20-[(5S)-5-methyl-3,4,5,6-tetrahydro-2-pyridinyl]pregn-5-ene-3,4-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H43NO2
InChI InChI=1S/C27H43NO2/c1-16-5-10-23(28-15-16)17(2)19-8-9-20-18-6-7-22-25(30)24(29)12-14-27(22,4)21(18)11-13-26(19,20)3/h7,16-21,24-25,29-30H,5-6,8-15H2,1-4H3/t16-,17-,18-,19+,20-,21-,24-,25+,26+,27+/m0/s1
InChIKey BLVNKXGGFFUMSS-CGYGGFEXSA-N
Molecular Weight 413.646 g/mol
SMILES O[C@@]1(C=2[C@](CC[C@@]1(O)[H])([C@]1(CC[C@@]3([C@](CC[C@]3([C@@]1(CC2)[H])[H])([C@@](C1=NC[C@](CC1)(C)[H])(C)[H])[H])C)[H])C)[H]
SPLASH splash10-01t9-4900000000-aa9b3ef69dd52e608578
Source of Spectrum G4-61-1207-6
Wiley ID 1607424