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CHOLESTA-5-ENE-3-BETA,19-DIOL

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CHOLESTA-5-ENE-3-BETA,19-DIOL
SpectraBase Compound ID EAr7vBx21HR
InChI InChI=1S/C27H46O2/c1-18(2)6-5-7-19(3)23-10-11-24-22-9-8-20-16-21(29)12-15-27(20,17-28)25(22)13-14-26(23,24)4/h8,18-19,21-25,28-29H,5-7,9-17H2,1-4H3/t19-,21+,22?,23-,24?,25?,26-,27-/m1/s1
InChIKey YRWIUNJQYGATHV-IKBZACSVSA-N
Mol Weight 402.7 g/mol
Molecular Formula C27H46O2
Exact Mass 402.349781 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4B1UgiFtYva
Name CHOLESTA-5-ENE-3-BETA,19-DIOL
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H46O2
InChI InChI=1S/C27H46O2/c1-18(2)6-5-7-19(3)23-10-11-24-22-9-8-20-16-21(29)12-15-27(20,17-28)25(22)13-14-26(23,24)4/h8,18-19,21-25,28-29H,5-7,9-17H2,1-4H3/t19-,21+,22?,23-,24?,25?,26-,27-/m1/s1
InChIKey YRWIUNJQYGATHV-IKBZACSVSA-N
Literature Reference Author W.ZHANG,Y.W.GUO,E.MOLLO,A.FONTANO,G.CIMINO
Literature Reference Citation J.NAT.PROD.,67,2083(2004)
Literature Reference DOI 10.1021/np049859a
Molecular Weight 402.661 g/mol
Solvent CDCl3
Source File Reference UWMZ6879