(1R)-5,6,7-trimethoxy-1-{[4-methoxy-3-(4-{[(5R)-9-methoxy-6-methyl-2H,5H,7H,8H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]methyl}phenoxy)phenyl]methyl}-2-methyl-3,4-dihydro-1H-isoquinoline

AlkaPlorer ID: AK098588

Synonym: None

IUPAC Name: 9-methoxy-5-[[4-[2-methoxy-5-[[(1S)-5,6,7-trimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenoxy]phenyl]methyl]-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline

Structure

SMILES: COC1=CC=C(C[C@H]2C3=CC(OC)=C(OC)C(OC)=C3CCN2C)C=C1OC1=CC=C(CC2C3=C(CCN2C)C(OC)=C2OCOC2=C3)C=C1

copy

InChI: InChI=1S/C40H46N2O8/c1-41-17-15-28-30(22-36-40(38(28)46-6)49-23-48-36)31(41)18-24-8-11-26(12-9-24)50-34-20-25(10-13-33(34)43-3)19-32-29-21-35(44-4)39(47-7)37(45-5)27(29)14-16-42(32)2/h8-13,20-22,31-32H,14-19,23H2,1-7H3/t31?,32-/m0/s1

copy

InChIKey: NUOHHDAPZZRIHO-JYUUXGOASA-N

copy

Reference

PubChem CID: 5316527

NPASS: NPC159195

Source

Properties Information

Molecule Weight: 682.8140000000002

TPSA: 80.32000000000001

MolLogP: 6.7940000000000085

Number of H-Donors: 0

Number of H-Acceptors: 10

RingCount: 7

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information