| SpectraBase Compound ID | 6GCfiaGID1l |
|---|---|
| InChI | InChI=1S/C24H34O6/c1-30-21-18-20(25)23(28)19(24(21)29)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-22(26)27/h2-3,15,17-18,28H,4-14,16H2,1H3,(H,26,27)/b3-2-,17-15+ |
| InChIKey | JHIASQUVYZBQHP-ZOVPFGTQSA-N |
| Mol Weight | 418.5 g/mol |
| Molecular Formula | C24H34O6 |
| Exact Mass | 418.235539 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AKEwdSeILYF |
|---|---|
| Name | Phlebiachrysoic acid C |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H34O6 |
| InChI | InChI=1S/C24H34O6/c1-30-21-18-20(25)23(28)19(24(21)29)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-22(26)27/h2-3,15,17-18,28H,4-14,16H2,1H3,(H,26,27)/b3-2-,17-15+ |
| InChIKey | JHIASQUVYZBQHP-ZOVPFGTQSA-N |
| Molecular Weight | 418.530 g/mol |
| SMILES | OC1=C(CCCCCCC\C=C/CCCCC\C=C\C(=O)O)C(C(=CC1=O)OC)=O |
| SPLASH | splash10-014i-1900600000-fe92faedb083226cbed6 |
| Source of Spectrum | U-1997-316-2 |
| Synonyms | (2E,9Z)-17-(2-hydroxy-5-methoxy-3,6-dioxo-1,4-cyclohexadien-1-yl)-2,9-heptadecadienoic acid (2E,9Z)-17-(2-hydroxy-5-methoxy-3,6-dioxo-1-cyclohexa-1,4-dienyl)heptadeca-2,9-dienoic acid (2E,9Z)-17-(2-hydroxy-5-methoxy-3,6-dioxocyclohexa-1,4-dien-1-yl)heptadeca-2,9-dienoic acid (2E,9Z)-17-(2-hydroxy-5-methoxy-3,6-dioxo-cyclohexa-1,4-dien-1-yl)heptadeca-2,9-dienoic acid (2E,9Z)-17-[5-methoxy-2-oxidanyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]heptadeca-2,9-dienoic acid |
| Wiley ID | 769298 |