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CHEBI:182840 - (3R,8R)-10-[(2R,5R)-3,5-Dihydroxy-6-methyloxan-2-yl]oxy-3,8-dihydroxyundecanoic acid
| Formula | C17H32O8 |
| Net Charge | 0 |
| Average Mass | 364.435 |
| Monoisotopic Mass | 364.20972 |
| SMILES | CC(C[C@H](O)CCCC[C@@H](O)CC(=O)O)O[C@@H]1OC(C)[C@H](O)CC1O |
| WURCS | WURCS=2.0/1,1,0/[axd1xm-1u_1-5_1*OC^XCC^RCCCCC^RCCO/12=O/10O/5O/3C]/1/ |
| InChI | InChI=1S/C17H32O8/c1-10(24-17-15(21)9-14(20)11(2)25-17)7-12(18)5-3-4-6-13(19)8-16(22)23/h10-15,17-21H,3-9H2,1-2H3,(H,22,23)/t10?,11?,12-,13-,14-,15?,17-/m1/s1 |
| InChIKey | KOPWGKUEIMDQOP-YSEGPLCXSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | small intestine (BTO:0000651) | MetaboLights (MTBLS3486) | Strain: C57BL/6 Mouse [THESAURUS.OWL#C14424] |
| Nippostrongylus brasiliensis (ncbitaxon:27835) | Whole Organism (NCIT:C13413) | MetaboLights (MTBLS3486) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (3R,8R)-10-[(2R,5R)-3,5-Dihydroxy-6-methyloxan-2-yl]oxy-3,8-dihydroxyundecanoic acid (CHEBI:182840) is a L-α-D-Hepp-(1→7)-L-α-D-Hepp-(1→3)-L-α-D-Hepp-(1→5)-α-Kdo (CHEBI:78618) |
| IUPAC Name |
|---|
| (3R,8R)-10-[(2R,5R)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3,8-dihydroxyundecanoic acid |