α'-Oxoperakensimine C; (R)-form 

AlkaPlorer ID: AK309003

Synonym: None

IUPAC Name: (7-hydroxy-6-methoxy-3,4-dihydroisoquinolin-1-yl)-[4-[5-[(7-hydroxy-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]-2-methoxyphenoxy]phenyl]methanone

Structure

SMILES: COC1=CC2=C(C=C1O)C(C(=O)C1=CC=C(OC3=CC(CC4C5=CC(O)=C(OC)C=C5CCN4C)=CC=C3OC)C=C1)=NCC2

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InChI: InChI=1S/C36H36N2O7/c1-38-14-12-24-18-33(44-4)29(39)19-26(24)28(38)15-21-5-10-31(42-2)34(16-21)45-25-8-6-22(7-9-25)36(41)35-27-20-30(40)32(43-3)17-23(27)11-13-37-35/h5-10,16-20,28,39-40H,11-15H2,1-4H3

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InChIKey: SVIQSSSOYSVSNB-UHFFFAOYSA-N

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Reference

CAS: 1174908-30-5

Source

Properties Information

Molecule Weight: 608.6910000000001

TPSA: 110.05

MolLogP: 5.915700000000006

Number of H-Donors: 2

Number of H-Acceptors: 9

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information