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16-ALPHA,25-DIHYDROXYEBURRICONIC_ACID;(20-ZETA)-3-OXO-16-ALPHA,25-DIHYDROXY-24-METHYLLANOSTA-8,24-(24-(1))-DIEN-21-OIC_ACID

View entire compound with spectra: 1 NMR

16-ALPHA,25-DIHYDROXYEBURRICONIC_ACID;(20-ZETA)-3-OXO-16-ALPHA,25-DIHYDROXY-24-METHYLLANOSTA-8,24-(24-(1))-DIEN-21-OIC_ACID
SpectraBase Compound ID LeDphONcMwr
InChI InChI=1S/C31H48O5/c1-18(28(4,5)36)9-10-19(26(34)35)25-22(32)17-31(8)21-11-12-23-27(2,3)24(33)14-15-29(23,6)20(21)13-16-30(25,31)7/h19,22-23,25,32,36H,1,9-17H2,2-8H3,(H,34,35)/t19?,22-,23+,25+,29-,30-,31+/m1/s1
InChIKey YEXYFLGTSGQWMI-BBQKHDEISA-N
Mol Weight 500.7 g/mol
Molecular Formula C31H48O5
Exact Mass 500.350175 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jeo5Fn6xyan
Name 16-ALPHA,25-DIHYDROXYEBURRICONIC_ACID;(20-ZETA)-3-OXO-16-ALPHA,25-DIHYDROXY-24-METHYLLANOSTA-8,24-(24-(1))-DIEN-21-OIC_ACID
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H48O5
InChI InChI=1S/C31H48O5/c1-18(28(4,5)36)9-10-19(26(34)35)25-22(32)17-31(8)21-11-12-23-27(2,3)24(33)14-15-29(23,6)20(21)13-16-30(25,31)7/h19,22-23,25,32,36H,1,9-17H2,2-8H3,(H,34,35)/t19?,22-,23+,25+,29-,30-,31+/m1/s1
InChIKey YEXYFLGTSGQWMI-BBQKHDEISA-N
Literature Reference Author T.AKIHISA,E.UCHIYAMA,T.KIKUCHI,H.TOKUDA,T.SUZUKI,Y.KIMURA
Literature Reference Citation J.NAT.PROD.,72,1786(2009)
Literature Reference DOI 10.1021/np9003239
Molecular Weight 500.719 g/mol
Sample ID 33662
Solvent C5D5N