BIAdb Hydrocotarnine 2294

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BIAdb Hydrocotarnine 2294
Systematic (IUPAC) name
4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolinehydrate hydrochloride
Identifiers
CAS number	?
ATC code	?
PubChem	11070
Chemical data
Formula	C12H18ClNO4
Mol. mass	275.72862
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

N/A

Function

Unknown

General Properties

*Molecular Weight

275.72862

*Exact Mass

275.092436

*Molecular Formula

C₁₂H₁₈ClNO₄

*IUPAC NAME

4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolinehydrate hydrochloride

*Canonical Smiles

CN1CCC2=CC3=C(C(=C2C1)OC)OCO3.O.Cl

*Isomeric Smiles

N/A

*XLogP

N/A

*Hydrogen bond donor

2

*Hydrogen bond acceptor

5

*Rotational Bond Count

1

*Topological Polar Surface Area

31.9

External Links

• Pubchem

• KEGG

Link to BIAdb Database