CHEBI:81341 - Capillartemisin A

ChEBI IDCHEBI:81341
ChEBI NameCapillartemisin A
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FormulaC19H24O4
Net Charge0
Average Mass316.397
Monoisotopic Mass316.16746
SMILESCC(C)=CCc1cc(/C=C/C(=O)O)cc(C/C=C(\C)CO)c1O
InChIInChI=1S/C19H24O4/c1-13(2)4-7-16-10-15(6-9-18(21)22)11-17(19(16)23)8-5-14(3)12-20/h4-6,9-11,20,23H,7-8,12H2,1-3H3,(H,21,22)/b9-6+,14-5+
InChIKeyHEFPIIHDRLNTDN-JBFPSKHUSA-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)
Capillartemisin A (CHEBI:81341) is a hydroxycinnamic acid (CHEBI:24689)
Manual XrefsDatabases
C17789KEGG COMPOUND
Registry NumbersSources
CAS:85819-52-9KEGG COMPOUND