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Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
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> Main
CHEBI:31334 - (
E
)-caffeyl alcohol
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ChEBI Ontology
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ChEBI Name
(
E
)-caffeyl alcohol
ChEBI ID
CHEBI:31334
ChEBI ASCII Name
(E)-caffeyl alcohol
Definition
A caffeyl alcohol in which the double bond has
E
geochemistry.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C9H10O3
Net Charge
0
Average Mass
166.17390
Monoisotopic Mass
166.06299
InChI
InChI=1S/C9H10O3/c10-5-1-2-7-3-4-8(11)9(12)6-7/h1-4,6,10-12H,5H2/b2-1+
InChIKey
ZCKDCRKBURQZPT-OWOJBTEDSA-N
SMILES
OC\C=C\c1ccc(O)c(O)c1
ChEBI Ontology
Outgoing
(
E
)-caffeyl alcohol (
CHEBI:31334
)
has functional parent
(
E
)-cinnamyl alcohol (
CHEBI:33227
)
(
E
)-caffeyl alcohol (
CHEBI:31334
)
is a
caffeyl alcohol (
CHEBI:86071
)
IUPAC Name
4-[(1
E
)-3-hydroxyprop-1-en-1-yl]benzene-1,2-diol
Synonyms
Sources
(
E
)-caffeyl alcohol
UniProt
3,4-dihydroxycinnamyl alcohol
ChEBI
Caffeyl alcohol
KEGG COMPOUND
Registry Number
Type
Source
2042377
Reaxys Registry Number
Reaxys
Citation
Type
Source
14745009
PubMed citation
Europe PMC
Last Modified
17 June 2015