Desmethylemetine

1-[(3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl)methyl]-7-methoxy-1,2,3,4-tetrahydroisoquinolin-6-ol

CAS: 10159-64-5

Molecular Formula	`C28H38N2O4`
Molecular Weight	466.6 g/mol
LogP	4.4
Topological Polar Surface Area	63.2 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	466.28317
Heavy Atoms	34
Complexity	664.0

Chemical Identifiers

CAS Number	10159-64-5
SMILES	`CCC1CN2CCC3=CC(=C(C=C3C2CC1CC4C5=CC(=C(C=C5CCN4)O)OC)OC)OC`
InChIKey	`DTGZHCFJNDAHEN-UHFFFAOYSA-N`

📖 Product Overview

Desmethylemetine (CAS: 10159-64-5) is a chemical compound with molecular formula C28H38N2O4 and molecular weight 466.6 g/mol. Its IUPAC systematic name is 1-[(3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl)methyl]-7-methoxy-1,2,3,4-tetrahydroisoquinolin-6-ol. LogP 4.4 Topological Polar Surface Area 63.2 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 6 Exact Mass 466.28317 Heavy Atoms 34 Complexity 664.0 InChI Key: DTGZHCFJNDAHEN-UHFFFAOYSA-N. SMILES: CCC1CN2CCC3=CC(=C(C=C3C2CC1CC4C5=CC(=C(C=C5CCN4)O)OC)OC)OC.

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