CHEBI:125666 - 3-amino-N-[2-(3,4-dihydroxyphenyl)ethyl]propanamide

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ChEBI Name 3-amino-N-[2-(3,4-dihydroxyphenyl)ethyl]propanamide
ChEBI ID CHEBI:125666
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C11H16N2O3
Net Charge 0
Average Mass 224.257
Monoisotopic Mass 224.11609
InChI InChI=1S/C11H16N2O3/c12-5-3-11(16)13-6-4-8-1-2-9(14)10(15)7-8/h1-2,7,14-15H,3-6,12H2,(H,13,16)
InChIKey KGZWXTYWZFMLSQ-UHFFFAOYSA-N
SMILES C1=CC(=C(C=C1CCNC(=O)CCN)O)O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 3-amino-N-[2-(3,4-dihydroxyphenyl)ethyl]propanamide (CHEBI:125666) has functional parent dopamine (CHEBI:18243)
3-amino-N-[2-(3,4-dihydroxyphenyl)ethyl]propanamide (CHEBI:125666) is a catechols (CHEBI:33566)
3-amino-N-[2-(3,4-dihydroxyphenyl)ethyl]propanamide (CHEBI:125666) is a primary amino compound (CHEBI:50994)
3-amino-N-[2-(3,4-dihydroxyphenyl)ethyl]propanamide (CHEBI:125666) is a secondary carboxamide (CHEBI:140325)
Manual Xref Database
LSM-37233 LINCS
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Last Modified
07 March 2018