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15-ALPHA-HYDROXYLYCERNUIC-ACID-E;3-BETA,21-BETA-DIACETOXY-14-ALPHA,15-ALPHA-DIHYDROXYSERRATANE-24-OIC-ACID
SpectraBase Compound ID 2w26omywNDd
InChI InChI=1S/C34H54O8/c1-19(35)41-26-12-15-32(7)23-10-9-21-30(5,18-34(23,40)25(37)17-24(32)29(26,3)4)14-11-22-31(21,6)16-13-27(42-20(2)36)33(22,8)28(38)39/h21-27,37,40H,9-18H2,1-8H3,(H,38,39)/t21-,22+,23+,24-,25-,26+,27-,30-,31+,32+,33+,34+/m0/s1
InChIKey PCUYHPFKNRRINO-SRLPHFQZSA-N
Mol Weight 590.8 g/mol
Molecular Formula C34H54O8
Exact Mass 590.381869 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 16dQWgyOq3q
Name 15-BETA-HYDROXYLYCERNUIC-ACID-E;3-BETA,21-BETA-DIACETOXY-14-BETA,15-BETA-DIHYDROXYSERRATANE-24-OIC-ACID
Compound Number 7C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H54O8
InChI InChI=1S/C34H54O8/c1-19(35)41-26-12-15-32(7)23-10-9-21-30(5,18-34(23,40)25(37)17-24(32)29(26,3)4)14-11-22-31(21,6)16-13-27(42-20(2)36)33(22,8)28(38)39/h21-27,37,40H,9-18H2,1-8H3,(H,38,39)/t21-,22+,23+,24-,25-,26+,27-,30-,31+,32+,33+,34+/m0/s1
InChIKey PCUYHPFKNRRINO-SRLPHFQZSA-N
Literature Reference Author Z.ZHANG,H.N.ELSOHLY,M.R.JACOB,D.S.PASCO,L.A.WALKER,A.M.CLARK
Literature Reference Citation J.NAT.PROD.,65,979(2002)
Literature Reference DOI 10.1021/np0200616
Molecular Weight 590.798 g/mol
Solvent C5D5N
Source File Reference UWSI4366