1-({3-ethyl-9,10-dimethoxy-1H,2H,3H,4H,6H,7H,11bH-pyrido[2,1-a]isoquinolin-2-yl}methyl)-7-methoxy-2,3,4,6-tetrahydroisoquinolin-6-one

AlkaPlorer ID: AK355753

Synonym: None

IUPAC Name: 1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-3,4-dihydroisoquinolin-6-ol

Structure

SMILES: CC[C@H]1CN2CCC3=CC(OC)=C(OC)C=C3[C@@H]2C[C@@H]1CC1=C2C=C(OC)C(=O)C=C2CCN1

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InChI: InChI=1S/C28H36N2O4/c1-5-17-16-30-9-7-19-13-27(33-3)28(34-4)15-22(19)24(30)11-20(17)10-23-21-14-26(32-2)25(31)12-18(21)6-8-29-23/h12-15,17,20,24,29H,5-11,16H2,1-4H3/t17-,20-,24-/m0/s1

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InChIKey: CLNILJPYOXIKRO-REIDKSKDSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Pogonopus speciosus Pogonopus Rubiaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 464.60600000000034

TPSA: 60.03

MolLogP: 4.326000000000003

Number of H-Donors: 1

Number of H-Acceptors: 6

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information