| Record Information |
|---|
| HMDB Status | expected |
|---|
| Creation Date | 2024-02-20 23:35:05 UTC |
|---|
| Update Date | 2025-03-21 17:56:51 UTC |
|---|
| HMDB ID | HMDB0003529 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00004066 |
|---|
| Name | myo-Inositol 1,3,4,5,6-pentakisphosphate |
|---|
| Frequency | 1400.6 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H17O21P5 |
|---|
| Molecular Mass | 579.895 |
|---|
| SMILES | O=P(O)(O)OC1C(O)C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C1OP(=O)(O)O |
|---|
| InChI Key | CTPQAXVNYGZUAJ-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | alcohols and polyols |
|---|
| Direct Parent | inositol phosphates |
|---|
| Geometric Descriptor | aliphatic homomonocyclic compounds |
|---|
| Alternative Parents | cyclohexanolshydrocarbon derivativesmonoalkyl phosphatesorganic oxides |
|---|
| Substituents | cyclohexanolinositol phosphateorganic oxidephosphoric acid estermonoalkyl phosphatesecondary alcoholaliphatic homomonocyclic compoundhydrocarbon derivativeorganic phosphoric acid derivativealkyl phosphate |
|---|
