EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:18225 - myo-inositol 1,3-bisphosphate
| Formula | C6H14O12P2 |
| Net Charge | 0 |
| Average Mass | 340.114 |
| Monoisotopic Mass | 339.99605 |
| SMILES | O=P(O)(O)O[C@@H]1[C@H](O)[C@H](OP(=O)(O)O)[C@@H](O)[C@H](O)[C@H]1O |
| InChI | InChI=1S/C6H14O12P2/c7-1-2(8)5(17-19(11,12)13)4(10)6(3(1)9)18-20(14,15)16/h1-10H,(H2,11,12,13)(H2,14,15,16)/t1-,2-,3+,4+,5+,6- |
| InChIKey | PUVHMWJJTITUGO-FICORBCRSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | - | DOI (10.1038/nbt.2488) |
| Roles Classification |
|---|
| Biological Role: | human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| myo-inositol 1,3-bisphosphate (CHEBI:18225) has functional parent myo-inositol (CHEBI:17268) |
| myo-inositol 1,3-bisphosphate (CHEBI:18225) has role human metabolite (CHEBI:77746) |
| myo-inositol 1,3-bisphosphate (CHEBI:18225) is a myo-inositol bisphosphate (CHEBI:25443) |
| myo-inositol 1,3-bisphosphate (CHEBI:18225) is conjugate acid of 1D-myo-inositol 1,3-biphosphate(4−) (CHEBI:83242) |
| Incoming Relation(s) |
| 1D-myo-inositol 1,3-biphosphate(4−) (CHEBI:83242) is conjugate base of myo-inositol 1,3-bisphosphate (CHEBI:18225) |
| IUPAC Name |
|---|
| myo-inositol 1,3-bis(dihydrogen phosphate) |
| Synonyms | Source |
|---|---|
| 1D-myo-Inositol 1,3-bisphosphate | KEGG COMPOUND |
| D-myo-Inositol 1,3-bisphosphate | KEGG COMPOUND |
| Inositol 1,3-bisphosphate | KEGG COMPOUND |
| myo-Inositol 1,3-bisphosphate | KEGG COMPOUND |
| PHOSPHORIC ACID MONO-(2,3,4,6-TETRAHYDROXY-5-PHOSPHONOOXY-CYCLOHEXYL) ESTER | PDBeChem |