Stepharanine

AlkaPlorer ID: AK341499

Synonym: None

IUPAC Name: None

Structure

SMILES: COC1=CC2=C(C=C1O)C1=CC3=C(C=[N+]1CC2)C(OC)=C([O-])C=C3

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InChI: InChI=1S/C19H17NO4/c1-23-18-8-12-5-6-20-10-14-11(3-4-16(21)19(14)24-2)7-15(20)13(12)9-17(18)22/h3-4,7-10H,5-6H2,1-2H3,(H-,21,22)

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InChIKey: BENXORZPKXUGMY-UHFFFAOYSA-N

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Reference

Alkaloids of Stephania sinica

LOTUS: LTS0159859

SuperNatural Ⅲ: SN0023390

Source

Properties Information

Molecule Weight: 323.348

TPSA: 65.63000000000001

MolLogP: 2.1468

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens Cytochrome P450 3A4 IC50 2500.0 nM 10.1021/np0704248

Metabolism Information