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(23E)-25-Hydroxy-Cucurbita-5,23-diene-3,7-dione
SpectraBase Compound ID HRxR9fu58uz
InChI InChI=1S/C30H46O3/c1-19(10-9-14-26(2,3)33)20-13-15-30(8)25-23(31)18-22-21(11-12-24(32)27(22,4)5)28(25,6)16-17-29(20,30)7/h9,14,18-21,25,33H,10-13,15-17H2,1-8H3/b14-9+/t19-,20-,21-,25-,28+,29-,30+/m1/s1
InChIKey PFROKAUESVZIJA-OEQOENRXSA-N
Mol Weight 454.7 g/mol
Molecular Formula C30H46O3
Exact Mass 454.344695 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5TXmT3F3tkl
Name (23-E)-25-HYDROXY-CUCURBITA-5,23-DIENE-3,7-DIONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H46O3
InChI InChI=1S/C30H46O3/c1-19(10-9-14-26(2,3)33)20-13-15-30(8)25-23(31)18-22-21(11-12-24(32)27(22,4)5)28(25,6)16-17-29(20,30)7/h9,14,18-21,25,33H,10-13,15-17H2,1-8H3/b14-9+/t19-,20-,21-,25-,28+,29-,30+/m1/s1
InChIKey PFROKAUESVZIJA-OEQOENRXSA-N
Literature Reference Author C.I.CHANG,C.R.CHEN,Y.W.LIAO,H.L.CHENG,Y.C.CHEN,C.H.CHOU
Literature Reference Citation J.NAT.PROD.,69,1168(2006)
Literature Reference DOI 10.1021/np068008v
Molecular Weight 454.693 g/mol
Solvent CDCl3
Source File Reference UWMZ15561