| SpectraBase Compound ID | 9zqD1jmQMR9 |
|---|---|
| InChI | InChI=1S/C31H50O7/c1-26(2)10-11-31(25(37)38-7)18(12-26)17-8-9-21-27(3)13-20(34)24(36)28(4,16-32)23(27)19(33)14-30(21,6)29(17,5)15-22(31)35/h8,18-24,32-36H,9-16H2,1-7H3/t18-,19+,20-,21+,22+,23+,24-,27+,28-,29+,30+,31+/m0/s1 |
| InChIKey | PAZGROQHTWGXSK-BFGLKAEMSA-N |
| Mol Weight | 534.7 g/mol |
| Molecular Formula | C31H50O7 |
| Exact Mass | 534.355654 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4RRdYW9m3n5 |
|---|---|
| Name | 2-BETA,3-BETA,6-BETA,16-ALPHA,23-PENTA-HYDROXYOLEAN-12-EN-28-OIC_ACID_METHYLESTER |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H50O7 |
| InChI | InChI=1S/C31H50O7/c1-26(2)10-11-31(25(37)38-7)18(12-26)17-8-9-21-27(3)13-20(34)24(36)28(4,16-32)23(27)19(33)14-30(21,6)29(17,5)15-22(31)35/h8,18-24,32-36H,9-16H2,1-7H3/t18-,19+,20-,21+,22+,23+,24-,27+,28-,29+,30+,31+/m0/s1 |
| InChIKey | PAZGROQHTWGXSK-BFGLKAEMSA-N |
| Literature Reference Author | P.GARIBOLDI,L.VEROTTA,B.GABETTA |
| Literature Reference Citation | PHYTOCHEM.,29,2629(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)85201-P |
| Molecular Weight | 534.734 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ21209 |