Allantoin Biotin structure

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)

CAS: 4492-73-3
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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