BIAdb (S)-Scoulerine 3250

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BIAdb (S)-Scoulerine 3250
Systematic (IUPAC) name
(13aS)-3,10-dimethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-2,9-diol
Identifiers
CAS number  ?
ATC code  ?
PubChem 439654
Chemical data
Formula C19H21NO4
Mol. mass 327.37434
SMILES eMolecules & PubChem
Pharmacokinetic data
Bioavailability  ?
Metabolism  ?
Half life  ?
Excretion  ?
Therapeutic considerations
Pregnancy cat.

?

Legal status
Routes  ?

Contents

Description

Source

Papaver pinnatifidum

Function

Unknown

General Properties

*Molecular Weight

327.37434

*Exact Mass

327.147058

*Molecular Formula

C19H21NO4

*IUPAC NAME

(13aS)-3,10-dimethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-2,9-diol

*Canonical Smiles

COC1=C(C2=C(CC3C4=CC(=C(C=C4CCN3C2)OC)O)C=C1)O

*Isomeric Smiles

COC1=C(C2=C(C[C@H]3C4=CC(=C(C=C4CCN3C2)OC)O)C=C1)O

*XLogP

2.6

*Hydrogen bond donor

2

*Hydrogen bond acceptor

5

*Rotational Bond Count

2

*Topological Polar Surface Area

62.2

External Links

Link to BIAdb Database