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BFA-17;3-BETA,30-DIHYDROXY-OLEAN-12-ENE-28-OIC-ACID-28-O-BETA-D-GLUCOPYRANOSIDE;QUERETAROIC-ACID-28-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 5VsOV6ndaa8
InChI InChI=1S/C36H58O9/c1-31(2)23-9-12-35(6)24(33(23,4)11-10-25(31)39)8-7-20-21-17-32(3,19-38)13-15-36(21,16-14-34(20,35)5)30(43)45-29-28(42)27(41)26(40)22(18-37)44-29/h7,21-29,37-42H,8-19H2,1-6H3/t21-,22+,23-,24+,25-,26+,27-,28+,29-,32-,33-,34+,35+,36-/m0/s1
InChIKey WFBRNEFMHKPSKX-QOBSNSOZSA-N
Mol Weight 634.9 g/mol
Molecular Formula C36H58O9
Exact Mass 634.408083 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4VnSCQxPahG
Name BFA-17;3-BETA,30-DIHYDROXY-OLEAN-12-ENE-28-OIC-ACID-28-O-BETA-D-GLUCOPYRANOSIDE;QUERETAROIC-ACID-28-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H58O9
InChI InChI=1S/C36H58O9/c1-31(2)23-9-12-35(6)24(33(23,4)11-10-25(31)39)8-7-20-21-17-32(3,19-38)13-15-36(21,16-14-34(20,35)5)30(43)45-29-28(42)27(41)26(40)22(18-37)44-29/h7,21-29,37-42H,8-19H2,1-6H3/t21-,22+,23-,24+,25-,26+,27-,28+,29-,32-,33-,34+,35+,36-/m0/s1
InChIKey WFBRNEFMHKPSKX-QOBSNSOZSA-N
Literature Reference Author Y.NAKAHARA,M.OKAWA,J.KINJO,T.NOHARA
Literature Reference Citation CHEM.PHARM.BULL.,59,1329(2011)
Literature Reference DOI 10.1248/cpb.59.1329
Molecular Weight 634.851 g/mol
Source File Reference UWIR3684