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(Q105182883)
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English
1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
group of stereoisomers with the chemical formula C₁₉H₂₄O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
camphan monoterpenoid
1 reference
inferred from
camphan monoterpenoid
alkyl caffeate ester
1 reference
inferred from
alkyl caffeate ester
mass
316.16745924799994
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₄O₄
0 references
canonical SMILES
O=C(OC1CC2CCC1(C)C2(C)C)C=CC3=CC=C(O)C(O)=C3
0 references
isomeric SMILES
CC1(C)C2CCC1(C)C(OC(=O)/C=C/c1ccc(O)c(O)c1)C2
1 reference
based on heuristic
inferred from InChI
found in taxon
Piper lanatum
1 reference
stated in
Antibacterial hydroxycinnamic esters from Piper caninum from Paluma, north Queensland, Australia. The crystal and molecular structure of (+)-bornyl coumarate
Piper caninum
1 reference
stated in
Antibacterial hydroxycinnamic esters from Piper caninum from Paluma, north Queensland, Australia. The crystal and molecular structure of (+)-bornyl coumarate
Identifiers
InChI
InChI=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+
0 references
InChIKey
NOYGOWYVUFENNY-FNORWQNLSA-N
0 references
PubChem CID
5477248
2 references
stated in
PubChem
retrieved
26 April 2024
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NOYGOWYVUFENNY-FNORWQNLSA-N
ChEBI ID
157708
mapping relation type
exact match
2 references
stated in
ChEBI release 2021-03-01
matched by identifier from
International Chemical Identifier
InChI
InChI=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+
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