CHEBI:57586 - biotinate

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ChEBI Name biotinate
ChEBI ID CHEBI:57586
Definition Conjugate base of biotin arising from deprotonation of the carboxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C10H15N2O3S
Net Charge -1
Average Mass 243.30300
Monoisotopic Mass 243.080
InChI InChI=1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/p-1/t6-,7-,9-/m0/s1
InChIKey YBJHBAHKTGYVGT-ZKWXMUAHSA-M
SMILES [H][C@]12CS[C@@H](CCCCC([O-])=O)[C@@]1([H])NC(=O)N2
Metabolite of Species Details
Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing biotinate (CHEBI:57586) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
biotinate (CHEBI:57586) has role human metabolite (CHEBI:77746)
biotinate (CHEBI:57586) is a monocarboxylic acid anion (CHEBI:35757)
biotinate (CHEBI:57586) is conjugate base of biotin (CHEBI:15956)
Incoming biotinate sulfoxide(1−) (CHEBI:62046) has functional parent biotinate (CHEBI:57586)
biotin (CHEBI:15956) is conjugate acid of biotinate (CHEBI:57586)
IUPAC Name
5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoate
Synonyms Sources
biotin UniProt
biotinate anion ChEBI
Manual Xref Database
BIOTIN MetaCyc
View more database links
Registry Number Type Source
10186323 Beilstein Registry Number Beilstein
Last Modified
21 January 2016