CID596431

From DrugPedia: A Wikipedia for Drug discovery

Revision as of 00:00, 15 January 2001 (edit) Special:Contributions/ (Talk) m ← Previous diff

Current revision (05:53, 23 April 2009) (edit) (undo) Raghavagps (Talk | contribs) m (1 revision)

---

Current revision

Show 3-D Structure

Show 2-D Structure

CID596431
Systematic (IUPAC) name
1-[(4-hydroxy-3-methoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol
Identifiers
CAS number	?
ATC code	?
PubChem	596431
Chemical data
Formula	C17H19NO4
Mol. mass	301.33706
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

[edit] Description

[edit] General Properties

*Molecular Weight

301.33706

*Molecular Formula

C₁₇H₁₉NO₄

*IUPAC NAME

1-[(4-hydroxy-3-methoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol

*Canonical Smiles

COC1=C(C=CC(=C1)CC2C3=CC(=C(C=C3CCN2)O)O)O

*Isomeric Smiles

N/A

*XLogP

2.1

*Topological Polar Surface Area

82

[edit] External Links

• Pubchem

Link to BIAdb Database