Hamatinine

AlkaPlorer ID: AK012529

Synonym: '', '(-)-Ancistrocladinine', 'Ancistrocladinine', 'Ancistrocladinin'

IUPAC Name: (3S)-5-(4,5-dimethoxy-2-methylnaphthalen-1-yl)-8-methoxy-1,3-dimethyl-3,4-dihydroisoquinolin-6-ol

Structure

SMILES: COC1=CC(O)=C(C2=C(C)C=C(OC)C3=C2C=CC=C3OC)C2=C1C(C)=N[C@@H](C)C2

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InChI: InChI=1S/C25H27NO4/c1-13-10-20(29-5)25-16(8-7-9-19(25)28-4)22(13)24-17-11-14(2)26-15(3)23(17)21(30-6)12-18(24)27/h7-10,12,14,27H,11H2,1-6H3/t14-/m0/s1

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InChIKey: NXPYZSTXOUQQLT-AWEZNQCLSA-N

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Properties Information

Molecule Weight: 405.4940000000002

TPSA: 60.28

MolLogP: 5.300220000000005

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information