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ELFVINGIC-ACID-E;7-BETA,8-BETA-EPOXY-3-BETA,15-BETA,20S,28-TETRAHYDROXY-12,23-DIOXOLANOST-9(11),16-DIEN-26-OIC-ACID
SpectraBase Compound ID E1gXqxzyF1y
InChI InChI=1S/C30H42O9/c1-15(24(36)37)9-16(32)13-27(4,38)19-11-22(35)29(6)28(19,5)21(34)10-18-25(2)8-7-20(33)26(3,14-31)17(25)12-23-30(18,29)39-23/h10-11,15,17,20,22-23,31,33,35,38H,7-9,12-14H2,1-6H3,(H,36,37)/t15?,17?,20-,22+,23-,25-,26-,27+,28-,29+,30+/m0/s1
InChIKey KCQYWDVUFDEZQI-LJTSQIOBSA-N
Mol Weight 546.7 g/mol
Molecular Formula C30H42O9
Exact Mass 546.282883 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7Wz30hMr8Mr
Name ELFVINGIC-ACID-E;7-BETA,8-BETA-EPOXY-3-BETA,15-BETA,20S,28-TETRAHYDROXY-12,23-DIOXOLANOST-9(11),16-DIEN-26-OIC-ACID
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H42O9
InChI InChI=1S/C30H42O9/c1-15(24(36)37)9-16(32)13-27(4,38)19-11-22(35)29(6)28(19,5)21(34)10-18-25(2)8-7-20(33)26(3,14-31)17(25)12-23-30(18,29)39-23/h10-11,15,17,20,22-23,31,33,35,38H,7-9,12-14H2,1-6H3,(H,36,37)/t15?,17?,20-,22+,23-,25-,26-,27+,28-,29+,30+/m0/s1
InChIKey KCQYWDVUFDEZQI-LJTSQIOBSA-N
Literature Reference Author K.YOSHIKAWA,N.NISHIMURA,S.BANDO,S.ARIHARA,E.MATSUMURA,S.KATA YAMA
Literature Reference Citation J.NAT.PROD.,65,548(2002)
Literature Reference DOI 10.1021/np0103160
Molecular Weight 546.658 g/mol
Solvent C5D5N
Source File Reference UWSI5616