Details of the Drug

General Information of Drug (ID: DMXZGE5)

Drug Name

ATRINOSITOL

Synonyms

Atrinositol; Atrinositol [INN]; UNII-VYF3049W3N; VYF3049W3N; D-myo-Inositol 1,2,6-tris(dihydrogen phosphate); 28841-62-5; PP56; alpha-Trinositol; AC1L23WT; SCHEMBL636077; Inositol 1,2,6-triphosphate; CHEMBL2106016; myo-inositol 1,2,6-triphosphate; GKDKOMAJZATYAY-UOTPTPDRSA-N; GKDKOMAJZATYAY-GCVPSNMTSA-N; PP-56; C6H15O15P3; D-myo-inositol-126-triphosphate; ZINC71789368; LS-84057; D-chiro-Inositol 1,2,6-trisphosphoric acid; D-myo-Inositol-1,2,6-tris(hydrogen phosphate)

Indication

Disease Entry	ICD 11	Status	REF
Pain	MG30-MG3Z	Discontinued in Phase 2	[1]
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Drug Type

Small molecular drug

Structure

3D MOL

2D MOL

Chemical Identifiers

Formula: C6H15O15P3
Canonical SMILES: C1(C(C(C(C(C1O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)O)O
InChI: 1S/C6H15O15P3/c7-1-2(8)4(19-22(10,11)12)6(21-24(16,17)18)5(3(1)9)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?/m1/s1
InChIKey: GKDKOMAJZATYAY-GCVPSNMTSA-N

Cross-matching ID

PubChem CID: 65762
CAS Number: 28841-62-5
TTD ID: D0G1EE

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: 4222).