BIAdb Aknadicine 1094

From DrugPedia: A Wikipedia for Drug discovery

Revision as of 00:00, 15 January 2001 by Special:Contributions/ (Talk)
(diff) ←Older revision | Current revision (diff) | Newer revision→ (diff)
Jump to: navigation, search

Show 3-D Structure

Show 2-D Structure

BIAdb Aknadicine 1094
Systematic (IUPAC) name
N/A
Identifiers
CAS number  ?
ATC code  ?
PubChem 442156
Chemical data
Formula C19H23NO5
Mol. mass 345.38962
SMILES eMolecules & PubChem
Pharmacokinetic data
Bioavailability  ?
Metabolism  ?
Half life  ?
Excretion  ?
Therapeutic considerations
Pregnancy cat.

?

Legal status
Routes  ?

Contents

Description

Source

Stephania hernandifolia

Function

Antimicrobial

General Properties

*Molecular Weight

345.38962

*Exact Mass

345.157623

*Molecular Formula

C19H23NO5

*IUPAC NAME

N/A

*Canonical Smiles

COC1=C(C2=C(CCC34C2(CCN3)CC(=O)C(=C4OC)OC)C=C1)O

*Isomeric Smiles

COC1=C(C2=C(CC[C@@]34[C@@]2(CCN3)CC(=O)C(=C4OC)OC)C=C1)O

*XLogP

1.3

*Hydrogen bond donor

2

*Hydrogen bond acceptor

6

*Rotational Bond Count

3

*Topological Polar Surface Area

77

External Links

Link to BIAdb Database