| SpectraBase Compound ID | IQ7j6C48d8t |
|---|---|
| InChI | InChI=1S/C30H46O5/c1-25(2)20-9-12-29(6)21(27(20,4)11-10-22(25)31)8-7-18-19-17-26(3,23(32)33)13-15-30(19,24(34)35)16-14-28(18,29)5/h7,19-22,31H,8-17H2,1-6H3,(H,32,33)(H,34,35)/t19-,20-,21+,22-,26+,27-,28+,29+,30-/m0/s1 |
| InChIKey | MCHKKYSPJGWAHQ-PGUYSIQDSA-N |
| Mol Weight | 486.7 g/mol |
| Molecular Formula | C30H46O5 |
| Exact Mass | 486.334525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9BgorbOxyyK |
|---|---|
| Name | SERRATAGENIC-ACID;3-BETA-HYDROXY-OLEAN-12-ENE-28,29-DIOIC-ACID |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O5 |
| InChI | InChI=1S/C30H46O5/c1-25(2)20-9-12-29(6)21(27(20,4)11-10-22(25)31)8-7-18-19-17-26(3,23(32)33)13-15-30(19,24(34)35)16-14-28(18,29)5/h7,19-22,31H,8-17H2,1-6H3,(H,32,33)(H,34,35)/t19-,20-,21+,22-,26+,27-,28+,29+,30-/m0/s1 |
| InChIKey | MCHKKYSPJGWAHQ-PGUYSIQDSA-N |
| Literature Reference Author | S.S.YU,D.Q.YU,X.T.LIANG |
| Literature Reference Citation | PHYTOCHEM.,38,695(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00706-Y |
| Molecular Weight | 486.692 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS4903 |