I3P

D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE

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is present as a standalone ligand in 59 entries

as a non-polymer is covalently linked to polymer or other heterogen groups 1 entries

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Chemical Component Summary
Name	D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE
Identifiers	[(1R,2R,3S,4R,5R,6S)-2,3,6-trihydroxy-4,5-diphosphonooxy-cyclohexyl] dihydrogen phosphate
Formula	C₆ H₁₅ O₁₅ P₃
Molecular Weight	420.096
Type	NON-POLYMER
Isomeric SMILES	[C@H]1([C@@H]([C@H]([C@@H]([C@H]([C@@H]1OP(=O)(O)O)O)OP(=O)(O)O)OP(=O)(O)O)O)O
InChI	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)/t1-,2+,3+,4-,5-,6-/m1/s1
InChIKey	MMWCIQZXVOZEGG-XJTPDSDZSA-N

Chemical Details
Formal Charge	0
Atom Count	39
Chiral Atom Count	6
Bond Count	39
Aromatic Bond Count	0

Drug Info: DrugBank

DrugBank ID	DB03401
Name	1D-myo-inositol 1,4,5-trisphosphate
Groups	experimental
Description	Intracellular messenger formed by the action of phospholipase C on phosphatidylinositol 4,5-bisphosphate, which is one of the phospholipids that make up the cell membrane. Inositol 1,4,5-trisphosphate is released into the cytoplasm where it releases calcium ions from internal stores within the cell's endoplasmic reticulum. These calcium ions stimulate the activity of B kinase or calmodulin.
Synonyms	IP3 D-myo-Inositol-1,4,5-triphosphate Inositol 1,4,5-trisphosphate 1D-myo-inositol 1,4,5-trisphosphate Ins(1,4,5)P3 InsP3 1,4,5-Insp3 D-myo-Inositol 1,4,5-trisphosphate
Categories	Alcohols Carbohydrates Inositol 1,4,5-Trisphosphate Inositol Phosphates Sugar Alcohols Sugar Phosphates
CAS number	85166-31-0

Drug Targets

Name	Target Sequence	Pharmacological Action
Cytohesin-2	MEDGVYEPPDLTPEERMELENIRRRKQELLVEIQRLREELSEAMSEVEGL...	unknown
Epsin-1	MSTSSLRRQMKNIVHNYSEAEIKVREATSNDPWGPSSSLMSEIADLTYNV...	unknown
1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase delta-1	MDSGRDFLTLHGLQDDEDLQALLKGSQLLKVKSSSWRRERFYKLQEDCKT...	unknown
Radixin	MPKPINVRVTTMDAELEFAIQPNTTGKQLFDQVVKTVGLREVWFFGLQYV...	unknown
Spectrin beta chain, non-erythrocytic 1	MTTTVATDYDNIEIQQQYSDVNNRWDVDDWDNENSSARLFERSRIKALAD...	unknown
Inositol 1,4,5-trisphosphate receptor type 1	MSDKMSSFLHIGDICSLYAEGSTNGFISTLGLVDDRCVVQPETGDLNNPP...	unknown
Inositol-trisphosphate 3-kinase A	MTLPGGPTGMARPGGARPCSPGLERAPRRSVGELRLLFEARCAAVAAAAA...	unknown
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Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682