dauricine
AlkaPlorer ID: AK005042
Synonym: '', 'Dauricine'
IUPAC Name: 4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]phenoxy]phenol
Structure
SMILES: COC1=CC2=C(C=C1OC)C(CC1=CC=C(OC3=CC(C[C@@H]4C5=CC(OC)=C(OC)C=C5CCN4C)=CC=C3O)C=C1)N(C)CC2
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-/m1/s1
InChIKey: AQASRZOCERRGBL-IADGFXSZSA-N
Source
Properties Information
Molecule Weight: 624.7780000000002
TPSA?: 72.86
MolLogP?: 6.7623000000000095
Number of H-Donors: 1
Number of H-Acceptors: 8
RingCount: 6
Activities Information
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