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

*Links on SpectraBase are not permalinks.
PREMNONE-C;(5R*,6R*,7R*,8S*,9R*,10R*)-7-O-(TRANS-CINNAMOYL)-6-HYDROXY-12-OXO-3,13(16)-CLERODIEN-15-OIC-ACID-METHYLESTER
SpectraBase Compound ID 6iGEKu5fotf
InChI InChI=1S/C30H38O6/c1-19(17-26(33)35-6)23(31)18-29(4)21(3)27(28(34)30(5)20(2)11-10-14-24(29)30)36-25(32)16-15-22-12-8-7-9-13-22/h7-9,11-13,15-16,21,24,27-28,34H,1,10,14,17-18H2,2-6H3/b16-15+/t21-,24-,27-,28+,29+,30+/m1/s1
InChIKey BQVDTHYZGFCERA-GBOSTOGDSA-N
Mol Weight 494.6 g/mol
Molecular Formula C30H38O6
Exact Mass 494.266839 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 1aHkezDGJHp
Name PREMNONE-C;(5R*,6R*,7R*,8S*,9R*,10R*)-7-O-(TRANS-CINNAMOYL)-6-HYDROXY-12-OXO-3,13(16)-CLERODIEN-15-OIC-ACID-METHYLESTER
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H38O6
InChI InChI=1S/C30H38O6/c1-19(17-26(33)35-6)23(31)18-29(4)21(3)27(28(34)30(5)20(2)11-10-14-24(29)30)36-25(32)16-15-22-12-8-7-9-13-22/h7-9,11-13,15-16,21,24,27-28,34H,1,10,14,17-18H2,2-6H3/b16-15+/t21-,24-,27-,28+,29+,30+/m1/s1
InChIKey BQVDTHYZGFCERA-GBOSTOGDSA-N
Literature Reference Author Y.W.CHIN,W.P.JONES,Q.MI,I.RACHMAN,S.RISWAN,L.B.S.KARDONO,H.B .CHAI,N.R.FARNSWORTH
Literature Reference Citation PHYTOCHEM.,67,1243(2006)
Literature Reference DOI 10.1016/j.phytochem.2006.04.015
Molecular Weight 494.628 g/mol
Sample ID 66300
Solvent CD3OD