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(Q105330010)
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n-Dihydroferuloyltyramine
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
phenethylamine alkaloid
0 references
mass
315.147058152
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₁NO₄
0 references
canonical SMILES
COc1cc(CCC(=O)NCCc2ccc(O)cc2)ccc1O
0 references
found in taxon
Annona cherimola
1 reference
stated in
Amides from stems of annona cherimola
Annona squamosa
1 reference
stated in
Annosqualine: a Novel Alkaloid from the Stems ofAnnona squamosa
Haplophyllum tuberculatum
1 reference
stated in
Lignans, Amides, and Saponins from Haplophyllum tuberculatum and Their Antiprotozoal Activity
Identifiers
InChI
InChI=1S/C18H21NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-4,6-8,12,20-21H,5,9-11H2,1H3,(H,19,22)
0 references
InChIKey
XLIPDHTUSRZSKE-UHFFFAOYSA-N
0 references
CAS Registry Number
184877-32-5
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
16119667
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XLIPDHTUSRZSKE-UHFFFAOYSA-N
ChEBI ID
175048
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C18H21NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-4,6-8,12,20-21H,5,9-11H2,1H3,(H,19,22)
UniChem compound ID
454064
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID001164766
1 reference
matched by identifier from
InChIKey
InChIKey
XLIPDHTUSRZSKE-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0033028
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XLIPDHTUSRZSKE-UHFFFAOYSA-N
KNApSAcK ID
C00053994
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XLIPDHTUSRZSKE-UHFFFAOYSA-N
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