CHEBI:80591 - 7-Mercaptoheptanoic acid

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ChEBI Name 7-Mercaptoheptanoic acid
ChEBI ID CHEBI:80591
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C7H14O2S
Net Charge 0
Average Mass 162.25000
Monoisotopic Mass 162.07145
InChI InChI=1S/C7H14O2S/c8-7(9)5-3-1-2-4-6-10/h10H,1-6H2,(H,8,9)
InChIKey AZJTUYPIWZAMTM-UHFFFAOYSA-N
SMILES OC(=O)CCCCCCS
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 7-Mercaptoheptanoic acid (CHEBI:80591) is a medium-chain fatty acid (CHEBI:59554)
Manual Xrefs Databases
C00000772 KNApSAcK
C16593 KEGG COMPOUND
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Registry Number Type Source
52000-32-5 CAS Registry Number KEGG COMPOUND