EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C18H30O16 |
| Net Charge | 0 |
| Average Mass | 502.422 |
| Monoisotopic Mass | 502.15338 |
| SMILES | CC1OC(OCC2OC(O)C(OC3OC(C(=O)O)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O |
| WURCS | WURCS=2.0/3,3,2/[axxxxh-1x_1-5][axxxxA-1x_1-5][axxxxm-1x_1-5]/1-2-3/a2-b1_a6-c1 |
| InChI | InChI=1S/C18H30O16/c1-3-5(19)7(21)11(25)17(31-3)30-2-4-6(20)9(23)14(16(29)32-4)34-18-12(26)8(22)10(24)13(33-18)15(27)28/h3-14,16-26,29H,2H2,1H3,(H,27,28) |
| InChIKey | AXPSZMMQIWYVNQ-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Bos taurus (ncbitaxon:9913) | spermatozoon (BTO:0001277) | MetaboLights (MTBLS1071) | Strain: Holstein [LBO:0000132] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3,4,5-trihydroxy-6-[(2,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-3-yl)oxy]oxane-2-carboxylic acid (CHEBI:185314) is a oligosaccharide (CHEBI:50699) |
| IUPAC Name |
|---|
| 3,4,5-trihydroxy-6-[2,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-3-yl]oxyoxane-2-carboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| HMDB0124747 | HMDB |