EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C6H16O18P4 |
| Net Charge | 0 |
| Average Mass | 500.072 |
| Monoisotopic Mass | 499.92871 |
| SMILES | O=P(O)(O)OC1[C@H](O)[C@H](OP(=O)(O)O)C(OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1O |
| InChI | InChI=1S/C6H16O18P4/c7-1-3(21-25(9,10)11)2(8)5(23-27(15,16)17)6(24-28(18,19)20)4(1)22-26(12,13)14/h1-8H,(H2,9,10,11)(H2,12,13,14)(H2,15,16,17)(H2,18,19,20)/t1-,2-,3?,4-,5+,6?/m0/s1 |
| InChIKey | CIPFCGZLFXVXBG-FTSGZOCFSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Inositol 1,3,4,5-tetraphosphate (CHEBI:166489) is a inositol phosphate (CHEBI:24846) |
| IUPAC Name |
|---|
| [(1S,2S,4S,5R)-2,4-dihydroxy-3,5,6-triphosphonooxycyclohexyl] dihydrogen phosphate |
| Manual Xrefs | Databases |
|---|---|
| CPD-506 | MetaCyc |
| HMDB0001059 | HMDB |
| 96919 | ChemSpider |
| C01272 | KEGG COMPOUND |