BIAdb Alamarine 1095

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BIAdb Alamarine 1095
Systematic (IUPAC) name
N/A
Identifiers
CAS number	?
ATC code	?
PubChem	442157
Chemical data
Formula	C19H18N2O4
Mol. mass	338.35722
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

[edit] Description

[edit] Source

Alangium lamarckii

[edit] Function

laxative

[edit] General Properties

*Molecular Weight

338.35722

*Exact Mass

338.126657

*Molecular Formula

C₁₉H₁₈N₂O₄

*IUPAC NAME

N/A

*Canonical Smiles

CC(C1=C2C=C3C4=CC(=C(C=C4CCN3C(=O)C2=CN=C1)OC)O)O

*Isomeric Smiles

C[C@H](C1=C2C=C3C4=CC(=C(C=C4CCN3C(=O)C2=CN=C1)OC)O)O

*XLogP

1.2

*Hydrogen bond donor

2

*Hydrogen bond acceptor

5

*Rotational Bond Count

2

*Topological Polar Surface Area

82.9

[edit] External Links

• Pubchem

• KEGG

Link to BIAdb Database