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

*Links on SpectraBase are not permalinks.

(2S,3R,4E,8E,9'Z,12'Z)-N-9',12'-Octadecadienoyl-2-amino-9-methyl-4,8-octadecadiene-1,3-diol

View entire compound with spectra: 1 NMR

(2S,3R,4E,8E,9'Z,12'Z)-N-9',12'-Octadecadienoyl-2-amino-9-methyl-4,8-octadecadiene-1,3-diol
SpectraBase Compound ID LwCVZuGPcA
InChI InChI=1S/C37H67NO3/c1-4-6-8-10-12-13-14-15-16-17-18-19-21-23-28-32-37(41)38-35(33-39)36(40)31-27-24-26-30-34(3)29-25-22-20-11-9-7-5-2/h12-13,15-16,27,30-31,35-36,39-40H,4-11,14,17-26,28-29,32-33H2,1-3H3,(H,38,41)/b13-12+,16-15+,31-27+,34-30+/t35-,36+/m0/s1
InChIKey FROGMNGZNQLQMS-AZRUQUMZSA-N
Mol Weight 573.9 g/mol
Molecular Formula C37H67NO3
Exact Mass 573.512095 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 3cRVr2bQUZc
Name (2S,3R,4E,8E,9'Z,12'Z)-N-9',12'-OCTADECADIENOYL-2-AMINO-9-METHYL-4,8-OCTADECADIENE-1,3-DIOL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H67NO3
InChI InChI=1S/C37H67NO3/c1-4-6-8-10-12-13-14-15-16-17-18-19-21-23-28-32-37(41)38-35(33-39)36(40)31-27-24-26-30-34(3)29-25-22-20-11-9-7-5-2/h12-13,15-16,27,30-31,35-36,39-40H,4-11,14,17-26,28-29,32-33H2,1-3H3,(H,38,41)/b13-12+,16-15+,31-27+,34-30+/t35-,36+/m0/s1
InChIKey FROGMNGZNQLQMS-AZRUQUMZSA-N
Literature Reference Author Y.YAOITA,R.KOHATA,R.KAKUDA,K.MACHIDA,M.KIKUCHI
Literature Reference Citation CHEM.PHARM.BULL.,50,681(2002)
Literature Reference DOI 10.1248/cpb.50.681
Molecular Weight 573.944 g/mol
Solvent CDCl3
Source File Reference UWVN8184