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(23E)-Cucurbita-5,23,25-triene-3.beta.,7.beta.-diol
SpectraBase Compound ID I2ZJszC4mPM
InChI InChI=1S/C30H48O2/c1-19(2)10-9-11-20(3)21-14-15-30(8)26-24(31)18-23-22(12-13-25(32)27(23,4)5)28(26,6)16-17-29(21,30)7/h9-10,18,20-22,24-26,31-32H,1,11-17H2,2-8H3/b10-9+/t20-,21-,22-,24+,25+,26-,28-,29-,30+/m1/s1
InChIKey DTWHUIBEZJGCNK-WPPZOHPUSA-N
Mol Weight 440.7 g/mol
Molecular Formula C30H48O2
Exact Mass 440.365431 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5NYJhg1ybjz
Name (23-E)-CUCURBITA-5,23,25-TRIENE-3-BETA,7-BETA-DIOL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H48O2
InChI InChI=1S/C30H48O2/c1-19(2)10-9-11-20(3)21-14-15-30(8)26-24(31)18-23-22(12-13-25(32)27(23,4)5)28(26,6)16-17-29(21,30)7/h9-10,18,20-22,24-26,31-32H,1,11-17H2,2-8H3/b10-9+/t20-,21-,22-,24+,25+,26-,28-,29-,30+/m1/s1
InChIKey DTWHUIBEZJGCNK-WPPZOHPUSA-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 440.710 g/mol
Solvent CDCl3
Source File Reference UWMZ15562