| SpectraBase Compound ID | 7tjJciAwFjp |
|---|---|
| InChI | InChI=1S/C31H44O4/c1-2-29(32)25-21-17-13-10-8-11-15-19-23-27-30(33)26-22-18-14-9-6-4-3-5-7-12-16-20-24-28-31(34)35/h1,16,20-21,23,25,27,29-30,32-33H,3-14,17-18,22,26H2,(H,34,35)/b20-16+,25-21+,27-23+/t29-,30?/m0/s1 |
| InChIKey | BUDYGGALOGHSBM-CZIYPJBBSA-N |
| Mol Weight | 480.7 g/mol |
| Molecular Formula | C31H44O4 |
| Exact Mass | 480.32396 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H0tUD8gbF0t |
|---|---|
| Name | CORTICATIC-ACID-D |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H44O4 |
| InChI | InChI=1S/C31H44O4/c1-2-29(32)25-21-17-13-10-8-11-15-19-23-27-30(33)26-22-18-14-9-6-4-3-5-7-12-16-20-24-28-31(34)35/h1,16,20-21,23,25,27,29-30,32-33H,3-14,17-18,22,26H2,(H,34,35)/b20-16+,25-21+,27-23+/t29-,30?/m0/s1 |
| InChIKey | BUDYGGALOGHSBM-CZIYPJBBSA-N |
| Literature Reference Author | S.NISHIMURA,S.MATSUNAGA,M.SHIBAZAKI,K.SUZUKI,N.HARADA,H.NAOK I,N.FUSETANI |
| Literature Reference Citation | J.NAT.PROD.,65,1353(2002) |
| Literature Reference DOI | 10.1021/np020080f |
| Molecular Weight | 480.688 g/mol |
| Solvent | CDCl3 |