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CHEBI:16615 - biotin amide

ChEBI IDCHEBI:16615
ChEBI Namebiotin amide
Stars
DefinitionA monocarboxylic acid amide derived from biotin.
Secondary ChEBI IDsCHEBI:3109, CHEBI:13906, CHEBI:22883
Last Modified3 April 2015
DownloadsMolfile
FormulaC10H17N3O2S
Net Charge0
Average Mass243.332
Monoisotopic Mass243.10415
SMILES[H][C@]12CS[C@@H](CCCCC(N)=O)[C@@]1([H])NC(=O)N2
InChIInChI=1S/C10H17N3O2S/c11-8(14)4-2-1-3-7-9-6(5-16-7)12-10(15)13-9/h6-7,9H,1-5H2,(H2,11,14)(H2,12,13,15)/t6-,7-,9-/m0/s1
InChIKeyXFLVBMBRLSCJAI-ZKWXMUAHSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
biotin amide (CHEBI:16615) has functional parent biotin (CHEBI:15956)
biotin amide (CHEBI:16615) has role human metabolite (CHEBI:77746)
biotin amide (CHEBI:16615) is a biotins (CHEBI:51570)
biotin amide (CHEBI:16615) is a monocarboxylic acid amide (CHEBI:29347)
IUPAC Name 
5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide
Synonyms  Source
Biotin amideKEGG COMPOUND
biotinamideChemIDplus
UniProt Name  Source
biotin amideUniProt
Manual XrefsDatabases
C01893KEGG COMPOUND
CPD-574MetaCyc
HMDB0001458HMDB
Registry NumbersSources
Reaxys:86836Reaxys
CAS:6929-42-6ChemIDplus
CAS:6929-42-6KEGG COMPOUND
Citations