Chemical Component Summary

Name(1R,2S,3r,4R,5S,6s)-2,4,6-trihydroxycyclohexane-1,3,5-triyl tris[dihydrogen (phosphate)]
SynonymsD-myo-inositol-1,3,5-trisphosphate
Identifiers[2,4,6-tris(oxidanyl)-3,5-diphosphonooxy-cyclohexyl] dihydrogen phosphate
FormulaC6 H15 O15 P3
Molecular Weight420.096
TypeNON-POLYMER
Isomeric SMILESC1(C(C(C(C(C1OP(=O)(O)O)O)OP(=O)(O)O)O)OP(=O)(O)O)O
InChIInChI=1S/C6H15O15P3/c7-1-4(19-22(10,11)12)2(8)6(21-24(16,17)18)3(9)5(1)20-23(13,14)15/h1-9H,(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)/t1-,2-,3-,4-,5+,6-
InChIKeyRURWIJNHQMXJDV-GBKPYZKPSA-N

Chemical Details

Formal Charge0
Atom Count39
Chiral Atom Count0
Bond Count39
Aromatic Bond Count0