EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C6H17O21P5 |
| Net Charge | 0 |
| Average Mass | 580.051 |
| Monoisotopic Mass | 579.89504 |
| SMILES | O=P(O)(O)OC1[C@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)C(O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O |
| InChI | InChI=1S/C6H17O21P5/c7-1-2(23-28(8,9)10)4(25-30(14,15)16)6(27-32(20,21)22)5(26-31(17,18)19)3(1)24-29(11,12)13/h1-7H,(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)(H2,20,21,22)/t1?,2-,3+,4-,5-,6?/m1/s1 |
| InChIKey | CTPQAXVNYGZUAJ-GCVPSNMTSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Rattus norvegicus (ncbitaxon:10116) | INS-1 cell (BTO:0002135) | MetaboLights (MTBLS3963) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| D-myo-inositol-1,2,3,5,6-pentaphosphate (CHEBI:191030) is a inositol phosphate (CHEBI:24846) |
| IUPAC Name |
|---|
| [(1R,2R,4S,5R)-3-hydroxy-2,4,5,6-tetraphosphonooxycyclohexyl] dihydrogen phosphate |