| SpectraBase Compound ID | IeIM0lKbNeo |
|---|---|
| InChI | InChI=1S/C28H40O4/c1-15-18-10-12-27(5)21(26(18,4)14-20(29)22(15)30)8-7-19-17-13-25(2,3)11-9-16(17)23(31)24(32)28(19,27)6/h7,16-18,21,24,30,32H,8-14H2,1-6H3/t16-,17+,18-,21+,24-,26-,27+,28-/m0/s1 |
| InChIKey | QQWIUBKPPNCYMY-JHYKCHHWSA-N |
| Mol Weight | 440.6 g/mol |
| Molecular Formula | C28H40O4 |
| Exact Mass | 440.29266 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8kE1odbz36G |
|---|---|
| Name | REMANGILONE-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H40O4 |
| InChI | InChI=1S/C28H40O4/c1-15-18-10-12-27(5)21(26(18,4)14-20(29)22(15)30)8-7-19-17-13-25(2,3)11-9-16(17)23(31)24(32)28(19,27)6/h7,16-18,21,24,30,32H,8-14H2,1-6H3/t16-,17+,18-,21+,24-,26-,27+,28-/m0/s1 |
| InChIKey | QQWIUBKPPNCYMY-JHYKCHHWSA-N |
| Literature Reference Author | Y.DENG,T.Y.JIANG,S.SHENG,M.TIANASOA-RAMAMONJY,J.K.SNYDER |
| Literature Reference Citation | J.NAT.PROD.,62,471(1999) |
| Literature Reference DOI | 10.1021/np9805140 |
| Molecular Weight | 440.623 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP7966 |