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METHYL-13-ALPHA-ETHOXY-7-ALPHA-HYDROXYABIET-8(14)-ENOATE;METHYL-[1R-(1-ALPHA,4A-BETA,4B-ALPHA,7-BETA,9-ALPHA,10A-ALPHA)]-1,2,3,4,4A,4B,5,6,
SpectraBase Compound ID 94RGW3nT8AL
InChI InChI=1S/C23H38O4/c1-7-27-23(15(2)3)12-9-17-16(14-23)18(24)13-19-21(17,4)10-8-11-22(19,5)20(25)26-6/h14-15,17-19,24H,7-13H2,1-6H3/t17?,18-,19?,21-,22-,23+/m1/s1
InChIKey XEKFBYAXMLUPDU-PVHPPEQCSA-N
Mol Weight 378.6 g/mol
Molecular Formula C23H38O4
Exact Mass 378.27701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9qWkLimMATF
Name METHYL-13-ALPHA-ETHOXY-7-ALPHA-HYDROXYABIET-8(14)-ENOATE;METHYL-[1R-(1-ALPHA,4A-BETA,4B-ALPHA,7-BETA,9-ALPHA,10A-ALPHA)]-1,2,3,4,4A,4B,5,6,
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H38O4
InChI InChI=1S/C23H38O4/c1-7-27-23(15(2)3)12-9-17-16(14-23)18(24)13-19-21(17,4)10-8-11-22(19,5)20(25)26-6/h14-15,17-19,24H,7-13H2,1-6H3/t17?,18-,19?,21-,22-,23+/m1/s1
InChIKey XEKFBYAXMLUPDU-PVHPPEQCSA-N
Literature Reference Author S.PRINZ,U.MUELLNER,J.HEILMANN,K.WINKELMANN,O.STICHER,E.HASLI NGER,A.HUEFNER
Literature Reference Citation J.NAT.PROD.,65,1530(2002)
Literature Reference DOI 10.1021/np010656l
Molecular Weight 378.552 g/mol
Solvent CDCl3
Source File Reference UWSI7113