| SpectraBase Compound ID | HiyvmUxdHS3 |
|---|---|
| InChI | InChI=1S/C30H48O3/c1-19(2)9-8-10-20(26(32)33)21-13-17-30(7)23-11-12-24-27(3,4)25(31)15-16-28(24,5)22(23)14-18-29(21,30)6/h9,20-21,24-25,31H,8,10-18H2,1-7H3,(H,32,33)/t20?,21-,24+,25+,28-,29-,30+/m1/s1 |
| InChIKey | NBSBUIQBEPROBM-FHZHDSSISA-N |
| Mol Weight | 456.7 g/mol |
| Molecular Formula | C30H48O3 |
| Exact Mass | 456.360345 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IzTGcYh9G1d |
|---|---|
| Name | TREMATENOLIC-ACID |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O3 |
| InChI | InChI=1S/C30H48O3/c1-19(2)9-8-10-20(26(32)33)21-13-17-30(7)23-11-12-24-27(3,4)25(31)15-16-28(24,5)22(23)14-18-29(21,30)6/h9,20-21,24-25,31H,8,10-18H2,1-7H3,(H,32,33)/t20?,21-,24+,25+,28-,29-,30+/m1/s1 |
| InChIKey | NBSBUIQBEPROBM-FHZHDSSISA-N |
| Literature Reference Author | K.YOSHIKAWA,M.KUROBOSHI,S.ARIHARA,N.MIURA,N.TOJIMURA,K.SAKAM OTO |
| Literature Reference Citation | CHEM.PHARM.BULL.,50,1603(2002) |
| Literature Reference DOI | 10.1248/cpb.50.1603 |
| Molecular Weight | 456.709 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS20301 |