Primary Record
Volixibat
- In stock
- 1,037 g
- Purity
- 98.2 %
- CAS
- 1351444-01-3
Compound Identifiers & Properties
- CAS
- 1351444-01-3
- PubChem CID
- 54756402
- SMILES
- CCCC[C@@]1(CS(=O)(=O)C2=C(C=C(C=C2)N(C)C)[C@H]([C@H]1O)C3=CC(=CC=C3)NC(=O)N[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)COS(=O)(=O)[O-])O)OCC5=CC=CC=C5)O)CC.CCO.O.[K+]
- Canonical SMILES
- CCCC[C@]1(CC)CS(=O)(=O)c2ccc(N(C)C)cc2[C@@H](c2cccc(NC(=O)N[C@@H]3O[C@H](COS(=O)(=O)[O-])[C@@H](O)[C@H](OCc4ccccc4)[C@H]3O)c2)[C@H]1O.CCO.O.[K+]
Names & Synonyms
- Volixibat
- UNII-17D5LDM09J
- 17D5LDM09J
- Volixibat potassium monoethanolate monohydrate
- SHP-626
- 1351444-01-3
- Q27251903
- Urea, N-(3-((3S,4R,5R)-3-butyl-7-(dimethylamino)-3-ethyl-2,3,4,5-tetrahydro-4-hydroxy-1,1-dioxido-1-benzothiepin-5-yl)phenyl)-N'-(3-O-(phenylmethyl)-6-O-sulfo-beta-D-glucopyranosyl)-, potassium salt, compd. with ethanol, hydrate (1:1:1:1)
- 1025216-57-2
- UREA, N-(3-((3S,4R,5R)-3-BUTYL-7-(DIMETHYLAMINO)-3-ETHYL-2,3,4,5-TETRAHYDRO-4-HYDROXY-1,1-DIOXIDO-1-BENZOTHIEPIN-5-YL)PHENYL)-N'-(3-O-(PHENYLMETHYL)-6-O-SULFO-.BETA.-D-GLUCOPYRANOSYL)-, POTASSIUM SALT, COMPD. WITH ETHANOL, HYDRATE (1:1:1:1)
- Urea, N-[3-[(3S,4R,5R)-3-butyl-7-(dimethylamino)-3-ethyl-2,3,4,5-tetrahydro-4-hydroxy-1,1-dioxido-1-benzothiepin-5-yl]phenyl]-N'-[3-O-(phenylmethyl)- 6-O-sulfo-b-D-glucopyranosyl]-, potassium salt, compd. with ethanol, hydrate (1:1:1:1);Urea, N-[3-[(3S,4R,5R)-3-butyl-7-(dimethylamino)-3-ethyl-2,3,4,5-tetrahydro-4-hydroxy-1,1-dioxido-1-benzothiepin-5-yl]phenyl]-N'-[3-O-(phenylmethyl)- 6-O-sulfo-b-D-glucopyranosyl]-, potassium salt, compd. with ethanol, hydrate (1:1:1:1)