| SpectraBase Compound ID | Kcm7I7q0QFK |
|---|---|
| InChI | InChI=1S/C32H52O2/c1-21(2)11-10-12-22(3)24-15-19-32(9)26-13-14-27-29(5,6)28(34-23(4)33)17-18-30(27,7)25(26)16-20-31(24,32)8/h11,22,24,27-28H,10,12-20H2,1-9H3/t22-,24-,27-,28-,30+,31-,32+/m0/s1 |
| InChIKey | BQPPJGMMIYJVBR-SNLLUQKOSA-N |
| Mol Weight | 468.8 g/mol |
| Molecular Formula | C32H52O2 |
| Exact Mass | 468.396731 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9uflNuDDeEe |
|---|---|
| Name | TIRUCALLA-8,24-DIEN-3-BETA-OL-ACETATE;TIRUCALLOL-ACETATE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H52O2 |
| InChI | InChI=1S/C32H52O2/c1-21(2)11-10-12-22(3)24-15-19-32(9)26-13-14-27-29(5,6)28(34-23(4)33)17-18-30(27,7)25(26)16-20-31(24,32)8/h11,22,24,27-28H,10,12-20H2,1-9H3/t22-,24-,27-,28-,30+,31-,32+/m0/s1 |
| InChIKey | BQPPJGMMIYJVBR-SNLLUQKOSA-N |
| Literature Reference Author | T.AKIHISA,Y.KIMURA,K.KOIKE,T.SHIBATA,Z.Y.YOSHIDA,T.NIKAIDO,T .TAMURA |
| Literature Reference Citation | J.NAT.PROD.,61,409(1998) |
| Literature Reference DOI | 10.1021/np970490h |
| Molecular Weight | 468.764 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWGS31 |