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CHEBI:157708 - (-)-bornyl-caffeate

ChEBI IDCHEBI:157708
ChEBI Name(-)-bornyl-caffeate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H24O4
Net Charge0
Average Mass316.397
Monoisotopic Mass316.16746
SMILESCC1(C)C2CCC1(C)C(OC(=O)/C=C/c1ccc(O)c(O)c1)C2
InChIInChI=1S/C19H24O4/c1-18(2)13-8-9-19(18,3)16(11-13)23-17(22)7-5-12-4-6-14(20)15(21)10-12/h4-7,10,13,16,20-21H,8-9,11H2,1-3H3/b7-5+
InChIKeyNOYGOWYVUFENNY-FNORWQNLSA-N
Species of MetaboliteComponentSourceComments
Piper methysticum (ncbitaxon:130404)
crown root (PO:0000043) MetaboLights (MTBLS1485) Strain: Piper methysticum cv. Loa Kasa Leka
stem (BTO:0001300) MetaboLights (MTBLS1485) Strain: Piper methysticum cv. Loa Kasa Leka
lateral root (BTO:0005441) MetaboLights (MTBLS1485) Strain: Piper methysticum cv. Loa Kasa Leka
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(-)-bornyl-caffeate (CHEBI:157708) is a hydroxycinnamic acid (CHEBI:24689)
IUPAC Name 
(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
Manual XrefsDatabases
4585218ChemSpider