John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=6wiNeEROXfd SpectraBase Spectrum ID=291gkRRMpR8

(accessed ).
PSEUDOIRRORATIN-A;ENT-7-BETA,11-ALPHA,14-ALPHA-TRIHYDROXY-11-BETA,20-EPOXYKAUR-16-EN-15-ONE
SpectraBase Compound ID 6wiNeEROXfd
InChI InChI=1S/C20H28O5/c1-10-11-8-19(24)16-18(9-25-19)6-4-5-17(2,3)12(18)7-13(21)20(16,14(10)22)15(11)23/h11-13,15-16,21,23-24H,1,4-9H2,2-3H3/t11-,12+,13+,15+,16+,18-,19+,20+/m0/s1
InChIKey NDYPVJHBSKUXPP-VWIBHASISA-N
Mol Weight 348.44 g/mol
Molecular Formula C20H28O5
Exact Mass 348.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 291gkRRMpR8
Name PSEUDOIRRORATIN-A;ENT-7-BETA,11-ALPHA,14-ALPHA-TRIHYDROXY-11-BETA,20-EPOXYKAUR-16-EN-15-ONE
Compound Number 1
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O5
InChI InChI=1S/C20H28O5/c1-10-11-8-19(24)16-18(9-25-19)6-4-5-17(2,3)12(18)7-13(21)20(16,14(10)22)15(11)23/h11-13,15-16,21,23-24H,1,4-9H2,2-3H3/t11-,12+,13+,15+,16+,18-,19+,20+/m0/s1
InChIKey NDYPVJHBSKUXPP-VWIBHASISA-N
Literature Reference Author H.ZHANG,Z.FAN,G.T.TAN,H.B.CHAI,J.M.PEZZUTO,H.SUN,H.H.S.FONG
Literature Reference Citation J.NAT.PROD.,65,215(2002)
Literature Reference DOI 10.1021/np010420h
Molecular Weight 348.439 g/mol
Solvent C5D5N
Source File Reference UWSI2823
SpectraBase Batch ID 6jWfRtTuzk2