Primary record
Ablukast
- CAS
- 96566-25-5
- PubChem CID
- 57109
- SMILES
- CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCOC2=C(C=C3CCC(OC3=C2)C(=O)O)C(=O)C
- Molecular Formula
- C28H34O8
- Molecular Weight
- 498.572
- Exact Mass
- 498.2254
- InChI
- InChI=1S/C28H34O8/c1-4-8-21-23(12-10-20(17(2)29)27(21)31)34-13-6-5-7-14-35-26-16-25-19(15-22(26)18(3)30)9-11-24(36-25)28(32)33/h10,12,15-16,24,31H,4-9,11,13-14H2,1-3H3,(H,32,33)
- InChIKey
- FGGYJWZYDAROFF-UHFFFAOYSA-N
- LogP
- 5.1562
- TPSA
- 119.36
Names and synonyms
- Ablukast
- Ablukastum
- 96566-25-5
- Ablukast [USAN:INN]
- ABLUKAST SODIUM
- Ablukastum [INN-Latin]
- 000TKM5BBQ
- Ro-23-3544
- ABLUKAST [USAN]
- UNII-000TKM5BBQ
- Ablukast (USAN/INN)
- ABLUKAST [INN]
- Ro 23-3544
- AC1L1MCA
- RefChem:914901
- CHEMBL22016
- D09DIG
- AC1Q5GQ8
- SCHEMBL37501
- orb1305216
- Ro 23-3544/000
- DTXSID20869277
- CHEBI:229915
- C28H34O8
- CID57109
- BDBM50009071
- AKOS000278590
- AKOS040747736
- C28-H34-O8
- DA-50093