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

*Links on SpectraBase are not permalinks.
9,10-Secochola-5,7,10(19)-triene-3,24-diol, (3.beta.,5Z,7E)-
SpectraBase Compound ID LTIHtiy6O2q
InChI InChI=1S/C24H38O2/c1-17-8-11-21(26)16-20(17)10-9-19-7-4-14-24(3)22(12-13-23(19)24)18(2)6-5-15-25/h9-10,18,21-23,25-26H,1,4-8,11-16H2,2-3H3/b19-9+,20-10-/t18?,21-,22?,23?,24+/m0/s1
InChIKey NGXCNTOSISCERO-SYODYZEVSA-N
Mol Weight 358.6 g/mol
Molecular Formula C24H38O2
Exact Mass 358.28718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID ADwLVGWRr8J
Name 9,10-Secochola-5,7,10(19)-triene-3,24-diol, (3.beta.,5Z,7E)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 358.287180462 u
Formula C24H38O2
InChI InChI=1S/C24H38O2/c1-17-8-11-21(26)16-20(17)10-9-19-7-4-14-24(3)22(12-13-23(19)24)18(2)6-5-15-25/h9-10,18,21-23,25-26H,1,4-8,11-16H2,2-3H3/b19-9+,20-10-/t18?,21-,22?,23?,24+/m0/s1
InChIKey NGXCNTOSISCERO-SYODYZEVSA-N
Molecular Weight 358.566 g/mol
SMILES [C@]12(C(\C(=C\C=C/3C(CC[C@@](C3)(O)[H])=C)CCC1)CCC2C(CCCO)C)C