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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:89421 - 3,4-DHPEA-EA
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ChEBI Ontology
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ChEBI Name
3,4-DHPEA-EA
ChEBI ID
CHEBI:89421
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Formula
C19H22O8
Net Charge
0
Average Mass
378.374
Monoisotopic Mass
378.13147
InChI
InChI=1S/C19H22O8/c1-
3-
12-
13(14(18(23)
25-
2)
10-
27-
19(12)
24)
9-
17(22)
26-
7-
6-
11-
4-
5-
15(20)
16(21)
8-
11/h3-
5,8,10,13,19-
21,24H,6-
7,9H2,1-
2H3/b12-
3-
/t13-
,19+/m0/s1
InChIKey
BIWKXNFEOZXNLX-SQOYHTLWSA-N
SMILES
C1=C(C(=CC=C1CCOC(C[C@@H]/2C(=CO[C@H](\C2=C/C)O)C(OC)=O)=O)O)O
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
Found in urine
(BTO:0001419)
. See:
PubMed
ChEBI Ontology
Outgoing
3,4-DHPEA-EA (
CHEBI:89421
)
is a
alcohol (
CHEBI:30879
)
3,4-DHPEA-EA (
CHEBI:89421
)
is a
phenols (
CHEBI:33853
)
Synonyms
Sources
3,4-DHPEA-Elenolic acid mono-aldehyde
HMDB
methyl (2R,3Z,4S)-
4-
{2-
[2-
(3,4-
dihydroxyphenyl)ethoxy]-
2-
oxoethyl}-
3-
ethylidene-
2-
hydroxy-
3,4-
dihydro-
2H-
pyran-
5-
carboxylate
HMDB
Oleuropein-aglycone mono-aldehyde
HMDB
Manual Xref
Database
HMDB0029304
HMDB
View more database links
Citation
Type
Source
24023812
PubMed citation
Europe PMC