WormBase Tree Display for Molecule: WBMol:00005138
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| WBMol:00005138 | Public_name | icas#21 | |||
|---|---|---|---|---|---|
| Monoisotopic_mass | 501.273 | ||||
| SMILES | C[C@H](CCCCCCCC\C=C\C(O)=O)O[C@@H]1O[C@@H](C)[C@@H](C[C@H]1O)OC(=O)c1c[nH]c2ccccc12 | ||||
| InChi | InChI=1S/C28H39NO7/c1-19(13-9-7-5-3-4-6-8-10-16-26(31)32)34-28-24(30)17-25(20(2)35-28)36-27(33)22-18-29-23-15-12-11-14-21(22)23/h10-12,14-16,18-20,24-25,28-30H,3-9,13,17H2,1-2H3,(H,31,32)/b16-10+/t19-,20+,24-,25-,28-/m1/s1 | ||||
| InChiKey | KBWMSHDNIKOFRU-IROGMXPVSA-N | ||||
| Synonym | 12R-(3'R-hydroxy-5'R-O-(1H-indol-3-ylcarbonyl)-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-2E-heptadecenoic acid | ||||
| DB_info | Database | ChEBI | CHEBI_ID | 79107 | |
| SMID-DB | icas#21 | ||||
| Status | Detected | Paper_evidence | WBPaper00040624 | ||
| Detection_method | LC-MS | Paper_evidence | WBPaper00040624 | ||
| Extraction_method | EtOH | Paper_evidence | WBPaper00040624 | ||
| Endogenous_in | Caenorhabditis elegans | ||||
| Biofunction_role | Metabolite | Paper_evidence | WBPaper00040624 | ||
| Reference | WBPaper00038769 | ||||
| WBPaper00040624 |
