Korupensamine A

AlkaPlorer ID: AK009169

Synonym: '', 'Dataset-S1.212', 'ConMedNP.367', 'ConMedNP.368', 'ConMedNP.369', '(+)-Korupensamine B', 'Korupensamine A', 'Korupensamine B'

IUPAC Name: (1S,3S)-5-(4-hydroxy-5-methoxy-7-methylnaphthalen-1-yl)-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline-6,8-diol

Structure

SMILES: COC1=CC(C)=CC2=C(C3=C(O)C=C(O)C4=C3C[C@H](C)N[C@H]4C)C=CC(O)=C12

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InChI: InChI=1S/C23H25NO4/c1-11-7-15-14(5-6-17(25)23(15)20(8-11)28-4)22-16-9-12(2)24-13(3)21(16)18(26)10-19(22)27/h5-8,10,12-13,24-27H,9H2,1-4H3/t12-,13-/m0/s1

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InChIKey: JOXWHCNNDTWJPX-STQMWFEESA-N

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Properties Information

Molecule Weight: 379.4560000000001

TPSA: 81.95

MolLogP: 4.535820000000004

Number of H-Donors: 4

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information