EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C12H16O7 |
| Net Charge | 0 |
| Average Mass | 272.253 |
| Monoisotopic Mass | 272.08960 |
| SMILES | [H]Oc1c([H])c([H])c(O[H])c([C@]2([H])O[C@]([H])(C([H])([H])O[H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@@]2([H])O[H])c1[H] |
| InChI | InChI=1S/C12H16O7/c13-4-8-9(16)10(17)11(18)12(19-8)6-3-5(14)1-2-7(6)15/h1-3,8-18H,4H2/t8-,9-,10+,11-,12+/m1/s1 |
| InChIKey | QRWWXASRKFWQRP-ZIQFBCGOSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE-3,4,5-TRIOL (CHEBI:43070) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| (1S)-1,5-anhydro-1-(2,5-dihydroxyphenyl)-D-glucitol | PDBeChem |
| 2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE-3,4,5-TRIOL | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| H53 | PDBeChem |