| SpectraBase Compound ID | K2qbGt0tCfH |
|---|---|
| InChI | InChI=1S/C30H46O6/c1-25(2)13-15-30(24(35)36)16-14-27(4)17(21(30)22(25)32)7-8-18-26(3)11-10-20(31)29(6,23(33)34)19(26)9-12-28(18,27)5/h7,18-22,31-32H,8-16H2,1-6H3,(H,33,34)(H,35,36)/t18-,19-,20+,21-,22+,26-,27-,28-,29+,30+/m1/s1 |
| InChIKey | DVZQJJHIDXRSFW-VZCJQHKYSA-N |
| Mol Weight | 502.7 g/mol |
| Molecular Formula | C30H46O6 |
| Exact Mass | 502.329439 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5grIwkBYRes |
|---|---|
| Name | ILEXOLIC-ACID-B;3-BETA,19-ALPHA-DIHYDROXY-OLEAN-12-EN-23,28-DIOIC-ACID |
| Compound Number | 47 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O6 |
| InChI | InChI=1S/C30H46O6/c1-25(2)13-15-30(24(35)36)16-14-27(4)17(21(30)22(25)32)7-8-18-26(3)11-10-20(31)29(6,23(33)34)19(26)9-12-28(18,27)5/h7,18-22,31-32H,8-16H2,1-6H3,(H,33,34)(H,35,36)/t18-,19-,20+,21-,22+,26-,27-,28-,29+,30+/m1/s1 |
| InChIKey | DVZQJJHIDXRSFW-VZCJQHKYSA-N |
| Literature Reference Author | S.B.MAHATO,A.P.KUNDU |
| Literature Reference Citation | PHYTOCHEM.,37,1517(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)89569-2 |
| Molecular Weight | 502.692 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS5147 |