| SpectraBase Compound ID | D87YpBn5P4J |
|---|---|
| InChI | InChI=1S/C25H38O3/c1-17(9-10-21-20(16-26)15-23(27)28-21)11-13-24(4)19(3)12-14-25(5)18(2)7-6-8-22(24)25/h9,15,19,21-22,26H,2,6-8,10-14,16H2,1,3-5H3/b17-9+/t19-,21+,22-,24+,25+/m0/s1 |
| InChIKey | QQKDQHJTKIBERS-OGXBFCNVSA-N |
| Mol Weight | 386.6 g/mol |
| Molecular Formula | C25H38O3 |
| Exact Mass | 386.282095 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | nuXAAlPVV1 |
|---|---|
| Name | THORECTANDROL-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H38O3 |
| InChI | InChI=1S/C25H38O3/c1-17(9-10-21-20(16-26)15-23(27)28-21)11-13-24(4)19(3)12-14-25(5)18(2)7-6-8-22(24)25/h9,15,19,21-22,26H,2,6-8,10-14,16H2,1,3-5H3/b17-9+/t19-,21+,22-,24+,25+/m0/s1 |
| InChIKey | QQKDQHJTKIBERS-OGXBFCNVSA-N |
| Literature Reference Author | R.D.CHARAN,T.C.MCKEE,M.R.BOYD |
| Literature Reference Citation | J.NAT.PROD.,64,661(2001) |
| Literature Reference DOI | 10.1021/np000544e |
| Molecular Weight | 386.575 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWRU7129 |