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CHEBI:80848 - Anthopleurine

ChEBI IDCHEBI:80848
ChEBI NameAnthopleurine
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DownloadsMolfile
FormulaC7H15NO4
Net Charge0
Average Mass177.200
Monoisotopic Mass177.10011
SMILESC[N+](C)(C)C[C@H](O)[C@@H](O)C(=O)[O-]
InChIInChI=1S/C7H15NO4/c1-8(2,3)4-5(9)6(10)7(11)12/h5-6,9-10H,4H2,1-3H3/t5-,6+/m0/s1
InChIKeyZOPACRMLVDFSGJ-NTSWFWBYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Anthopleurine (CHEBI:80848) is a hydroxy fatty acid (CHEBI:24654)
Manual XrefsDatabases
C16994KEGG COMPOUND
Registry NumbersSources
CAS:56595-17-6KEGG COMPOUND