D-myo-inositol (1,4,5)-trisphosphate
Chemical Formula:
C6H9O15P3
Molecular Weight:
414.049 Daltons
Monoisotopic Mass:
419.96237934299995 Daltons
SMILES:
C1(O)(C(OP([O-])([O-])=O)C(O)C(OP(=O)([O-])[O-])C(OP(=O)([O-])[O-])C(O)1)
InChI:
1S/C6H15O15P3/c7-1-2(8)5(20-23(13,14)15)6(21-24(16,17)18)3(9)4(1)19-22(10,11)12/h1-9H,(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)/p-6/t1-,2+,3+,4-,5-,6-/m1/s1
InChIKey:
Synonyms
- inositol (1,4,5)-trisphosphate
- 1D-myo-inositol (1,4,5)-trisphosphate
- I(1,4,5)P3
- InsP3
- IP3
- triphosphoinositol
- Ins(1,4,5)P3
Databases
MetaCyc:
INOSITOL-1-4-5-TRISPHOSPHATE
MetaboLights:
MTBLC203600
HMDB:
HMDB01498
ChemSpider:
10375590
PubChem (CID):
21761708
Wikipedia:
Inositol_triphosphate
KEGG:
C01245
CAS:
85166-31-0
88269-39-0
MetaNetX:
MNXM200
PupChem (SID):
4466
CHEMBL:
CHEMBL279107
KNApSAcK:
C00007460
PDB-CCD:
I3P
NIKKAJI:
J260.291A