N-Cinnamoylputrescine; (E)-form, 3'',4''-Dihydroxy
AlkaPlorer ID: AK292516
Synonym: N-(4-Aminobutyl)-3-(3,4-dihydroxyphenyl)-2-propanamide, N-(3,4-Dihydroxycinnamoyl)-1,4-butanediamine, N-trans-Caffeoylputrescine, Paucine
IUPAC Name: (Z)-N-(4-aminobutyl)-3-(3,4-dihydroxyphenyl)prop-2-enamide
Structure
SMILES: NCCCCN=C(O)/C=C\C1=CC=C(O)C(O)=C1
InChI: InChI=1S/C13H18N2O3/c14-7-1-2-8-15-13(18)6-4-10-3-5-11(16)12(17)9-10/h3-6,9,16-17H,1-2,7-8,14H2,(H,15,18)/b6-4-
InChIKey: KTZNZCYTXQYEHT-XQRVVYSFSA-N
Source
Properties Information
Molecule Weight: 250.298
TPSA？: 99.07
MolLogP？: 1.8064
Number of H-Donors: 4
Number of H-Acceptors: 4
RingCount: 1
Activities Information
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