Details of the Drug

General Information of Drug (ID: DMJXC5G)

Drug Name

1,5,-IP2

Synonyms

Inositol 1,3-bisphosphate; myo-Inositol 1,3-bisphosphate; Inositol 1,3-diphosphate; Inositol(1,3)bisphosphate; 103597-56-4; myo-inositol 1,3-bis(dihydrogen phosphate); D-myo-Inositol 1,3-bisphosphate; 1D-myo-Inositol 1,3-bisphosphate; myo-Inositol, 1,3-bis(dihydrogen phosphate); PHOSPHORIC ACID MONO-(2,3,4,6-TETRAHYDROXY-5-PHOSPHONOOXY-CYCLOHEXYL) ESTER; 1joc; 1,5,-IP2; AC1Q6RUI; AC1L2TR6; (1r,3s,4r,6s)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl bis[dihydrogen(phosphate)]; SCHEMBL9872231; SCHEMBL5003539; GTPL5099

Indication

Disease Entry	ICD 11	Status	REF
Discovery agent	N.A.	Investigative	[1]
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Drug Type

Small molecular drug

Structure

3D MOL is unavailable

2D MOL

Chemical Identifiers

Formula: C6H14O12P2
Canonical SMILES: C1(C(C(C(C(C1O)OP(=O)(O)O)O)OP(=O)(O)O)O)O
InChI: 1S/C6H14O12P2/c7-1-2(8)5(17-19(11,12)13)4(10)6(3(1)9)18-20(14,15)16/h1-10H,(H2,11,12,13)(H2,14,15,16)/t1?,2-,3+,4?,5+,6-
InChIKey: PUVHMWJJTITUGO-WJPCITMWSA-N

Cross-matching ID

PubChem CID: 128419
ChEBI ID: CHEBI:18225
CAS Number: 103597-56-4
TTD ID: D0WV4Z

References

1	URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 5099).