| SpectraBase Compound ID | 1A2MWT7sJp4 |
|---|---|
| InChI | InChI=1S/C30H46O4/c1-17(2)23-19(31)16-30(25(33)34)15-14-28(6)18(24(23)30)8-9-21-27(5)12-11-22(32)26(3,4)20(27)10-13-29(21,28)7/h18,20-24,32H,1,8-16H2,2-7H3,(H,33,34)/t18?,20?,21?,22-,23+,24-,27-,28+,29+,30+/m0/s1 |
| InChIKey | MXJMQPDZBSPQBW-FMEVAEHOSA-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 | 3rv3BEUYJG5 |
|---|---|
| Name | 21-KETOBETULINIC-ACID |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O4 |
| InChI | InChI=1S/C30H46O4/c1-17(2)23-19(31)16-30(25(33)34)15-14-28(6)18(24(23)30)8-9-21-27(5)12-11-22(32)26(3,4)20(27)10-13-29(21,28)7/h18,20-24,32H,1,8-16H2,2-7H3,(H,33,34)/t18?,20?,21?,22-,23+,24-,27-,28+,29+,30+/m0/s1 |
| InChIKey | MXJMQPDZBSPQBW-FMEVAEHOSA-N |
| Literature Reference Author | Y.YE,K.KINOSHITA,K.KOYAMA,K.TAKAHASHI,N.KONDO,H.YUASA |
| Literature Reference Citation | J.NAT.PROD.,61,456(1998) |
| Literature Reference DOI | 10.1021/np970364d |
| Molecular Weight | 470.693 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCP7012 |