Allantoin Biotin
5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid;(2,5-dioxoimidazolidin-4-yl)urea
Also Known As: Allantoin biotin|Allantoinbiotin|ALLANTOIN BIOTIN [INCI]|Biotin, compd. with allantoin (1:1)|ALLANTOIN, COMPD. WITH BIOTIN (1:1)|1H-Thieno(3,4-d)imidazole-4-pentanoic acid, hexahydro-2-oxo-, (3aS,4S,6aR)-, compd. with N-(2,5-dioxo-4-imidazolidinyl)urea (1:1)|1H-Thieno(3,4-d)imidazole-4-pentanoic acid, hexahydro-2-oxo-, (3aS,4S,6aR)-, compd. with (2,5-dioxo-4-imidazolidinyl)urea (1:1)|1H-THIENO(3,4-D)IMIDAZOLE-4-PENTANOIC ACID, HEXAHYDRO-2-OXO-, (3AS-(3A.ALPHA.,4.BETA.,6A.ALPHA.))-, COMPD. WITH (2,5-DIOXO-4-IMIDAZOLIDINYL)UREA (1:1)|1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, (3aS,4S,6aR)-, compd. with (2,5-dioxo-4-imidazolidinyl)urea (1:1)|1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, (3aS,4S,6aR)-, compd. with N-(2,5-dioxo-4-imidazolidinyl)urea (1:1)|5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid;(2,5-dioxoimidazolidin-4-yl)urea|UREA, (2,5-DIOXO-4-IMIDAZOLIDINYL)-, MONO((3AS,4S,6AR)-HEXAHYDRO-2-OXO-1H-THIENO(3,4-D)IMIDAZOLE-4-PENTANOATE)|UREA, (2,5-DIOXO-4-IMIDAZOLIDINYL)-, MONO((3AS-(3A.ALPHA.,4.BETA.,6A.ALPHA.))-HEXAHYDRO-2-OXO-1H-THIENO(3,4-D)IMIDAZOLE-4-PENTANOATE)|1H-THIENO(3,4-D)IMIDAZOLE-4-PENTANOIC ACID, HEXAHYDRO-2-OXO-, (3AS-(3AALPHA,4BETA,6AALPHA))-, COMPD. WITH (2,5-DIOXO-4-IMIDAZOLIDINYL)UREA (1:1)|1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, [3aS-(3a.alpha.,4.beta.,6a.alpha.)]-, compd. with (2,5-dioxo-4-imidazolidinyl)urea (1:1)|5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid; (2,5-dioxoimidazolidin-4-yl)urea|5-[(3aS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoic acid--N-(2,5-dioxoimidazolidin-4-yl)urea (1/1)|Urea, (2, 5- dioxo- 4- imidazolydinyl)- , compound with 2H- thieno[3, 4- d]imidazole- 4- pentanoic acid, hexahydro- 2- oxo- , [3as- (3aalpha, 4b, 6aalpha)]-|UREA, (2,5-DIOXO-4-IMIDAZOLIDINYL)-, MONO((3AS-(3AALPHA,4BETA,6AALPHA))-HEXAHYDRO-2-OXO-1H-THIENO(3,4-D)IMIDAZOLE-4-PENTANOATE)
| Molecular Formula | C14H22N6O6S |
|---|---|
| Molecular Weight | 402.13214 g/mol |
| LogP | -1.383 |
| Topological Polar Surface Area | 191.75 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 402.13214 |
| Monoisotopic Mass | 402.13214 |
| Heavy Atoms | 27 |
| Complexity | 631.219 |
Chemical Identifiers
| CAS Number | 4492-73-3 |
|---|---|
| SMILES | C1[C@H]2[C@@H]([C@@H](S1)CCCCC(=O)O)NC(=O)N2.C1(C(=O)NC(=O)N1)NC(=O)N |
Product Overview
Allantoin Biotin (CAS 4492-73-3), with molecular formula C14H22N6O6S and molecular weight 402.13214 g/mol. IUPAC: 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid;(2,5-dioxoimidazolidin-4-yl)urea.
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