dauricine

AlkaPlorer ID: AK005041

Synonym: '', 'Dauricine'

IUPAC Name: 4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[4-[[(1S)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenoxy]phenol

Structure

SMILES: COC1=C(OC)C=C2C(=C1)CCN(C)[C@@H]2CC1=CC=C(O)C(OC2=CC=C(C[C@H]3C4=CC(OC)=C(OC)C=C4CCN3C)C=C2)=C1

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InChI: InChI=1S/C38H44N2O6/c1-39-15-13-26-20-35(42-3)37(44-5)22-29(26)31(39)17-24-7-10-28(11-8-24)46-34-19-25(9-12-33(34)41)18-32-30-23-38(45-6)36(43-4)21-27(30)14-16-40(32)2/h7-12,19-23,31-32,41H,13-18H2,1-6H3/t31-,32+/m0/s1

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InChIKey: AQASRZOCERRGBL-AJQTZOPKSA-N

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Source

Properties Information

Molecule Weight: 624.7780000000001

TPSA: 72.86000000000001

MolLogP: 6.762300000000008

Number of H-Donors: 1

Number of H-Acceptors: 8

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information