Coryneine
AlkaPlorer ID: AK293082
Synonym: 3,4-Dihydroxy-N,N,N-trimethylbenzenethanaminium(1+), (3,4-Dihydroxyphenethyl)trimethylammonium, Dopamine methosalt
IUPAC Name: 2-(3,4-dihydroxyphenyl)ethyl-trimethylazanium
Structure
SMILES: C[N+](C)(C)CCC1=CC=C(O)C(O)=C1
InChI: InChI=1S/C11H17NO2/c1-12(2,3)7-6-9-4-5-10(13)11(14)8-9/h4-5,8H,6-7H2,1-3H3,(H-,13,14)/p+1
InChIKey: VDTBORSEFUUDTP-UHFFFAOYSA-O
Source
Properties Information
Molecule Weight: 196.27
TPSA？: 40.46
MolLogP？: 1.3465
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 1
Activities Information
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