| SpectraBase Compound ID | 8CxixgjMcyo |
|---|---|
| InChI | InChI=1S/C30H46O4/c1-25(2)21-8-11-30(7)23(28(21,5)10-9-22(25)32)20(31)16-18-19-17-27(4,24(33)34)13-12-26(19,3)14-15-29(18,30)6/h16,19,21-23,32H,8-15,17H2,1-7H3,(H,33,34)/t19-,21-,22-,23+,26+,27-,28-,29+,30+/m0/s1 |
| InChIKey | MPDGHEJMBKOTSU-YKLVYJNSSA-N |
| Mol Weight | 470.7 g/mol |
| Molecular Formula | C30H46O4 |
| Exact Mass | 470.33961 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K2WlXwaHuWW |
|---|---|
| Name | 3beta-HYDROXY-11-OXOOLEAN-12-EN-30-OIC ACID |
| Source of Sample | E. Merck AG, Darmstadt, Germany |
| Comments | Some carbon atoms are unassigned |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H46O4 |
| InChI | InChI=1S/C30H46O4/c1-25(2)21-8-11-30(7)23(28(21,5)10-9-22(25)32)20(31)16-18-19-17-27(4,24(33)34)13-12-26(19,3)14-15-29(18,30)6/h16,19,21-23,32H,8-15,17H2,1-7H3,(H,33,34)/t19-,21-,22-,23+,26+,27-,28-,29+,30+/m0/s1 |
| InChIKey | MPDGHEJMBKOTSU-YKLVYJNSSA-N |
| Melting Point | 289-293C |
| Molecular Weight | 470.70 |
| Solvent | Polysol; Reference=TMS Spectrometer= Varian CFT-20 |
| Synonyms | OLEAN-12-EN-30-OIC ACID, 3B-HYDROXY-11-OXO-, GLYCYRRHETINIC ACID |