1D-myo-inositol 3-diphosphate 1,2,4,5,6-pentakisphosphate

Chemical Formula:

C₆H₇O₂₇P₇

Molecular Weight:

727.921 Daltons

Monoisotopic Mass:

739.8277009766 Daltons

SMILES:

C1(OP([O-])(=O)[O-])(C(OP([O-])(=O)[O-])C(OP(=O)([O-])[O-])C(OP(=O)([O-])OP(O)(=O)[O-])C(OP([O-])([O-])=O)C(OP([O-])([O-])=O)1)

InChI:

1S/C6H19O27P7/c7-34(8,9)27-1-2(28-35(10,11)12)4(30-37(16,17)18)6(32-40(25,26)33-39(22,23)24)5(31-38(19,20)21)3(1)29-36(13,14)15/h1-6H,(H,25,26)(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24)/p-12/t1-,2-,3+,4-,5-,6-/m0/s1

InChIKey:

UPHPWXPNZIOZJL-PTQMNWPWSA-B

Synonyms

3-PP-InsP₅
3-diphospho-1D-myo-inositol pentakisphosphate
3-diphospho-1D-myo-inositol 1,2,4,5,6-pentakisphosphate

Databases

MetaCyc: CPD-11937

PubChem (CID): 46173206