| SpectraBase Compound ID | 2xsRX1nhVmH |
|---|---|
| InChI | InChI=1S/C28H38O3/c1-16-19-10-12-27(5)23(26(19,4)14-22(30)24(16)31)8-7-20-18-13-25(2,3)11-9-17(18)21(29)15-28(20,27)6/h7,14,17-18,23,30H,8-13,15H2,1-6H3/t17-,18+,23+,26-,27+,28+/m0/s1 |
| InChIKey | RZJRSJIUNPKJLS-NOPRNUEKSA-N |
| Mol Weight | 422.6 g/mol |
| Molecular Formula | C28H38O3 |
| Exact Mass | 422.282095 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Etm6ricYwB8 |
|---|---|
| Name | REMANGILONE-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H38O3 |
| InChI | InChI=1S/C28H38O3/c1-16-19-10-12-27(5)23(26(19,4)14-22(30)24(16)31)8-7-20-18-13-25(2,3)11-9-17(18)21(29)15-28(20,27)6/h7,14,17-18,23,30H,8-13,15H2,1-6H3/t17-,18+,23+,26-,27+,28+/m0/s1 |
| InChIKey | RZJRSJIUNPKJLS-NOPRNUEKSA-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 | 422.608 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP7965 |