WormBase Tree Display for Molecule: WBMol:00005265
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WBMol:00005265 | Public_name | ibho#24 | |||
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Monoisotopic_mass | 533.299 | ||||
IUPAC | (3R)-14-{[3,6-dideoxy-4-O-(1H-indol-3-ylcarbonyl)-alpha-L-arabino-hexopyranosyl]oxy}-3-hydroxytetradecanoic acid | ||||
SMILES | C[C@@H]1O[C@@H](OCCCCCCCCCCC[C@@H](O)CC(O)=O)[C@H](O)C[C@H]1OC(=O)c1c[nH]c2ccccc12 | ||||
InChi | InChI=1S/C29H43NO8/c1-20-26(38-28(35)23-19-30-24-15-11-10-14-22(23)24)18-25(32)29(37-20)36-16-12-8-6-4-2-3-5-7-9-13-21(31)17-27(33)34/h10-11,14-15,19-21,25-26,29-32H,2-9,12-13,16-18H2,1H3,(H,33,34)/t20-,21+,25+,26+,29+/m0/s1 | ||||
InChiKey | LXVPUPUKAHIWDZ-STNUDKPESA-N | ||||
Synonym | 3R-hydroxy-14-(3'R-hydroxy-5'R-O-(1H-indol-3-ylcarbonyl)-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-tetradecanoic acid | ||||
DB_info | Database | ChEBI | CHEBI_ID | 79375 | |
ChemIDplus | RN | 1355683-47-4 | |||
SMID-DB | ibho#24 | ||||
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 |