CHEBI:205698 - Crabetailin

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Crabetailin
ChEBI ID CHEBI:205698
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H31NO4
Net Charge 0
Average Mass 349.471
Monoisotopic Mass 349.22531
InChI InChI=1S/C20H31NO4/c1-15(2)10-8-6-4-5-7-9-13-25-20(24)18-14-17(23)11-12-19(18)21-16(3)22/h11-12,14-15,23H,4-10,13H2,1-3H3,(H,21,22)
InChIKey NJZJMCDXDQVNID-UHFFFAOYSA-N
SMILES O=C(OCCCCCCCCC(C)C)C1=C(NC(=O)C)C=CC(=C1)O
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Crabetailin (CHEBI:205698) is a amidobenzoic acid (CHEBI:48470)
IUPAC Name
9-methyldecyl 2-acetamido-5-hydroxybenzoate