| SpectraBase Compound ID | Bk9Rq7KUYzI |
|---|---|
| InChI | InChI=1S/2C37H58O9/c2*1-32(2)15-17-37(31(42)43)18-16-35(6)20(21(37)19-32)9-10-23-34(5)13-12-24(33(3,4)22(34)11-14-36(23,35)7)45-30-27(40)25(38)26(39)28(46-30)29(41)44-8/h2*9,21-28,30,38-40H,10-19H2,1-8H3,(H,42,43)/t2*21-,22-,23+,24-,25-,26-,27+,28-,30+,34-,35+,36+,37-/m00/s1 |
| InChIKey | PXNNTBBIIWHLJB-ZXRZTKARSA-N |
| Mol Weight | 1293.7 g/mol |
| Molecular Formula | C74H116O18 |
| Exact Mass | 1292.816167 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9eeUViJUbCl |
|---|---|
| Name | OLEANOLIC-ACID-3-BETA-D-GLUCURONOPYRANOSIDE-METHYLESTER |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C74H116O18 |
| InChI | InChI=1S/2C37H58O9/c2*1-32(2)15-17-37(31(42)43)18-16-35(6)20(21(37)19-32)9-10-23-34(5)13-12-24(33(3,4)22(34)11-14-36(23,35)7)45-30-27(40)25(38)26(39)28(46-30)29(41)44-8/h2*9,21-28,30,38-40H,10-19H2,1-8H3,(H,42,43)/t2*21-,22-,23+,24-,25-,26-,27+,28-,30+,34-,35+,36+,37-/m00/s1 |
| InChIKey | PXNNTBBIIWHLJB-ZXRZTKARSA-N |
| Literature Reference Author | Y.SATOH,S.SAKAI,M.KATSUMATA,M.NAGASAO,M.MIYAKOSHI,Y.IDA,J.SH OJI |
| Literature Reference Citation | PHYTOCHEM.,36,147(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)97028-6 |
| Molecular Weight | 1293.724 g/mol |
| Solvent | Unknown |
| Source File Reference | UWLU25902 |