BIAdb Actinodaphine 1081

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Revision as of 10:46, 20 November 2009

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BIAdb Actinodaphine 1081
Systematic (IUPAC) name
N/A
Identifiers
CAS number	?
ATC code	?
PubChem	160502
Chemical data
Formula	C18H17NO4
Mol. mass	311.33188
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

Contents 1 Description 2 Source 3 Function 4 General Properties 5 External Links

Description

Source

Hernandia cordigera

Function

Antimicrobial

General Properties

*Molecular Weight

311.33188

*Exact Mass

311.115758

*Molecular Formula

C₁₈H₁₇NO₄

*IUPAC NAME

N/A

*Canonical Smiles

COC1=C(C=C2CC3C4=C(C2=C1)C5=C(C=C4CCN3)OCO5)O

*Isomeric Smiles

COC1=C(C=C2C[C@H]3C4=C(C2=C1)C5=C(C=C4CCN3)OCO5)O

*XLogP

2.4

*Hydrogen bond donor

2

*Hydrogen bond acceptor

5

*Rotational Bond Count

1

*Topological Polar Surface Area

60

External Links

• Pubchem

• KEGG

Link to BIAdb Database