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

*Links on SpectraBase are not permalinks.

THUNBERGOL-A;9-(3,4-DIHYDRO-2,8-DIMETHYL-6-HYDROXY-2H-1-BENZOPYRAN-2-YL)-6-METHYL-2-(4-METHYL-3-PENTENYL)-(2E,6E)-NONADIENOIC-ACID

View entire compound with spectra: 1 NMR

THUNBERGOL-A;9-(3,4-DIHYDRO-2,8-DIMETHYL-6-HYDROXY-2H-1-BENZOPYRAN-2-YL)-6-METHYL-2-(4-METHYL-3-PENTENYL)-(2E,6E)-NONADIENOIC-ACID
SpectraBase Compound ID EbsSCYt1Axd
InChI InChI=1S/C27H38O5/c1-18(2)9-6-12-21(26(30)31)13-7-10-19(3)11-8-14-27(5)24(29)17-22-16-23(28)15-20(4)25(22)32-27/h9,11,13,15-16,24,28-29H,6-8,10,12,14,17H2,1-5H3,(H,30,31)/b19-11+,21-13-
InChIKey PLMGIRQPZPSYEQ-LADKKCNBSA-N
Mol Weight 442.6 g/mol
Molecular Formula C27H38O5
Exact Mass 442.271924 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 19HQAZkpS44
Name THUNBERGOL-A;9-(3,4-DIHYDRO-2,8-DIMETHYL-6-HYDROXY-2H-1-BENZOPYRAN-2-YL)-6-METHYL-2-(4-METHYL-3-PENTENYL)-(2E,6E)-NONADIENOIC-ACID
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H38O5
InChI InChI=1S/C27H38O5/c1-18(2)9-6-12-21(26(30)31)13-7-10-19(3)11-8-14-27(5)24(29)17-22-16-23(28)15-20(4)25(22)32-27/h9,11,13,15-16,24,28-29H,6-8,10,12,14,17H2,1-5H3,(H,30,31)/b19-11+,21-13-
InChIKey PLMGIRQPZPSYEQ-LADKKCNBSA-N
Literature Reference Author Y.SEO,K.E.PARK,Y.A.KIM,H.J.LEE,J.S.YOO,J.W.AHN,B.J.LEE
Literature Reference Citation CHEM.PHARM.BULL.,54,1730(2006)
Literature Reference DOI 10.1248/cpb.54.1730
Molecular Weight 442.596 g/mol
Sample ID 55351
Solvent CDCl3