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METHYL-GANOLUCIDATE-A;METHYL-15-ALPHA-HYDROXY-3,11,23-TRIOXO-5-ALPHA-LANOST-8-EN-26-OATE
SpectraBase Compound ID GMNPdVe3XGu
InChI InChI=1S/C31H46O6/c1-17(13-19(32)14-18(2)27(36)37-8)21-15-25(35)31(7)20-9-10-23-28(3,4)24(34)11-12-29(23,5)26(20)22(33)16-30(21,31)6/h17-18,21,23,25,35H,9-16H2,1-8H3/t17-,18?,21+,23-,25-,29-,30+,31+/m0/s1
InChIKey HZSSXIBJQNNCMO-DZOQHBKGSA-N
Mol Weight 514.7 g/mol
Molecular Formula C31H46O6
Exact Mass 514.329439 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 90KXboPJCTc
Name METHYL-GANOLUCIDATE-A;METHYL-15-ALPHA-HYDROXY-3,11,23-TRIOXO-5-ALPHA-LANOST-8-EN-26-OATE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H46O6
InChI InChI=1S/C31H46O6/c1-17(13-19(32)14-18(2)27(36)37-8)21-15-25(35)31(7)20-9-10-23-28(3,4)24(34)11-12-29(23,5)26(20)22(33)16-30(21,31)6/h17-18,21,23,25,35H,9-16H2,1-8H3/t17-,18?,21+,23-,25-,29-,30+,31+/m0/s1
InChIKey HZSSXIBJQNNCMO-DZOQHBKGSA-N
Literature Reference Author Q.XIA,H.ZHANG,X.SUN,H.ZHAO,L.WU,D.ZHU,G.YANG,Y.SHAO,X.ZHANG, X.MAO,L.ZHANG,G.SHE
Literature Reference Citation MOLECULES,19,17478(2014)
Literature Reference DOI 10.3390/molecules191117478
Molecular Weight 514.703 g/mol
Solvent CDCl3
Source File Reference UWLU81705