WormBase Tree Display for Molecule: WBMol:00005256
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WBMol:00005256 | Public_name | ibha#26 | |||
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Monoisotopic_mass | 547.315 | ||||
IUPAC | (3R,14R)-14-{[3,6-dideoxy-4-O-(1H-indol-3-ylcarbonyl)-alpha-L-arabino-hexopyranosyl]oxy}-3-hydroxypentadecanoic acid | ||||
SMILES | C[C@H](CCCCCCCCCC[C@@H](O)CC(O)=O)O[C@@H]1O[C@@H](C)[C@@H](C[C@H]1O)OC(=O)c1c[nH]c2ccccc12 | ||||
InChi | InChI=1S/C30H45NO8/c1-20(13-9-7-5-3-4-6-8-10-14-22(32)17-28(34)35)37-30-26(33)18-27(21(2)38-30)39-29(36)24-19-31-25-16-12-11-15-23(24)25/h11-12,15-16,19-22,26-27,30-33H,3-10,13-14,17-18H2,1-2H3,(H,34,35)/t20-,21+,22-,26-,27-,30-/m1/s1 | ||||
InChiKey | UWTXRGDQDGZEBX-RZEARGRZSA-N | ||||
Synonym | 3R-hydroxy-14R-(3'R-hydroxy-5'R-O-(1H-indol-3-ylcarbonyl)-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-pentadecanoic acid | ||||
DB_info | Database | ChEBI | CHEBI_ID | 79358 | |
SMID-DB | ibha#26 | ||||
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 |