| SpectraBase Compound ID | EaO9XchExoL |
|---|---|
| InChI | InChI=1S/C31H48O4/c1-18-11-14-31(26(34)35-8)16-15-29(6)20(24(31)19(18)2)9-10-23-28(5)17-21(32)25(33)27(3,4)22(28)12-13-30(23,29)7/h9,19,21-25,32-33H,1,10-17H2,2-8H3/t19-,21?,22?,23-,24-,25?,28?,29-,30+,31-/m1/s1 |
| InChIKey | OFQVNFFJOVLEMM-NLXSBVPOSA-N |
| Mol Weight | 484.7 g/mol |
| Molecular Formula | C31H48O4 |
| Exact Mass | 484.35526 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6UcJ1lsrQmD |
|---|---|
| Name | Methyl-2.alpha.,3.alpha.-dihydroxy-ursa-12,20(30)-diene-28-oate |
| CAS Registry Number | 108908-93-6 |
| Comments | APT, DEPT, INE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C31H48O4 |
| InChI | InChI=1S/C31H48O4/c1-18-11-14-31(26(34)35-8)16-15-29(6)20(24(31)19(18)2)9-10-23-28(5)17-21(32)25(33)27(3,4)22(28)12-13-30(23,29)7/h9,19,21-25,32-33H,1,10-17H2,2-8H3/t19-,21?,22?,23-,24-,25?,28?,29-,30+,31-/m1/s1 |
| InChIKey | OFQVNFFJOVLEMM-NLXSBVPOSA-N |
| Instrument Name | SF = 400 MHz |
| Literature Reference | Phytochem. 26, 1107 (1987). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |