CHEBI:182944 - (1R,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptane-2beta-ol 3-(4-hydroxyphenyl)acrylate

ChEBI IDCHEBI:182944
ChEBI Name(1R,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptane-2beta-ol 3-(4-hydroxyphenyl)acrylate
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H24O3
Net Charge0
Average Mass300.398
Monoisotopic Mass300.17254
SMILES[H][C@@]12CC[C@@](C)([C@@H](OC(=O)/C=C/c3ccc(O)cc3)C1)C2(C)C
InChIInChI=1S/C19H24O3/c1-18(2)14-10-11-19(18,3)16(12-14)22-17(21)9-6-13-4-7-15(20)8-5-13/h4-9,14,16,20H,10-12H2,1-3H3/b9-6+/t14-,16+,19+/m1/s1
InChIKeyQDCGSCBAIQIGDY-SFTFJGOJSA-N
ChEBI Ontology
Outgoing Relation(s)
(1R,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptane-2beta-ol 3-(4-hydroxyphenyl)acrylate (CHEBI:182944) is a cinnamate ester (CHEBI:36087)
IUPAC Name 
[(1R,2S,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
Manual XrefsDatabases
30790827ChemSpider
C17850KEGG COMPOUND