![4-hydroxy-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]benzoic acid](/api/spectrum/8fS7ZSAwZ0n/structure.png?h=300&w=458 "4-hydroxy-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]benzoic acid")
| SpectraBase Compound ID | HOfIPUGOHlI |
|---|---|
| InChI | InChI=1S/C27H38O3/c1-20(2)9-6-10-21(3)11-7-12-22(4)13-8-14-23(5)15-16-24-19-25(27(29)30)17-18-26(24)28/h9,11,13,15,17-19,28H,6-8,10,12,14,16H2,1-5H3,(H,29,30)/b21-11+,22-13+,23-15+ |
| InChIKey | AQVOANKSGFAANH-FPFQZNTGSA-N |
| Mol Weight | 410.6 g/mol |
| Molecular Formula | C27H38O3 |
| Exact Mass | 410.282095 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8fS7ZSAwZ0n |
|---|---|
| Name | 4-hydroxy-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]benzoic acid |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H38O3 |
| InChI | InChI=1S/C27H38O3/c1-20(2)9-6-10-21(3)11-7-12-22(4)13-8-14-23(5)15-16-24-19-25(27(29)30)17-18-26(24)28/h9,11,13,15,17-19,28H,6-8,10,12,14,16H2,1-5H3,(H,29,30)/b21-11+,22-13+,23-15+ |
| InChIKey | AQVOANKSGFAANH-FPFQZNTGSA-N |
| Literature Reference Author | A.MAXWELL,D.RAMPERSAD |
| Literature Reference Citation | J.NAT.PROD.,52,614(1989) |
| Literature Reference DOI | 10.1021/np50063a022 |
| Molecular Weight | 410.597 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS154 |