4-Hydroxy-3-methoxyphenethylamine; N-(4-β-D-Glucopyranosyloxy-3-methoxy-E-cinnamoyl)
AlkaPlorer ID: AK301380
Synonym: None
IUPAC Name: (E)-N-[2-(4-hydroxy-3-methoxyphenyl)ethyl]-3-[3-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enamide
Structure
SMILES: COC1=CC(CCNC(=O)/C=C/C2=CC=C(OC3OC(CO)C(O)C(O)C3O)C(OC)=C2)=CC=C1O
InChI: InChI=1S/C25H31NO10/c1-33-18-11-15(3-6-16(18)28)9-10-26-21(29)8-5-14-4-7-17(19(12-14)34-2)35-25-24(32)23(31)22(30)20(13-27)36-25/h3-8,11-12,20,22-25,27-28,30-32H,9-10,13H2,1-2H3,(H,26,29)/b8-5+
InChIKey: UYSRWDYTMGBBHP-VMPITWQZSA-N
Source
Properties Information
Molecule Weight: 505.5200000000002
TPSA？: 167.17
MolLogP？: -0.0397999999999995
Number of H-Donors: 6
Number of H-Acceptors: 10
RingCount: 3
Activities Information
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