Acetoxy cochicine

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[http://crdd.osdd.net/raghava/biadb/detail.php?id=1987 Link to BIAdb Database]
[http://crdd.osdd.net/raghava/biadb/detail.php?id=1987 Link to BIAdb Database]
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[[Category:BIAdb_old]]

Current revision

Show 3-D Structure

Show 2-D Structure

Acetoxy cochicine
Systematic (IUPAC) name
(1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[d]heptalen-7-yl) acetate
Identifiers
CAS number  ?
ATC code  ?
PubChem 634461
Chemical data
Formula C22H24O6S
Mol. mass 416.48736
SMILES eMolecules & PubChem
Pharmacokinetic data
Bioavailability  ?
Metabolism  ?
Half life  ?
Excretion  ?
Therapeutic considerations
Pregnancy cat.

?

Legal status
Routes  ?

[edit] Description

[edit] General Properties

*Molecular Weight

416.48736

*Molecular Formula

C22H24O6S

*IUPAC NAME

(1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[d]heptalen-7-yl) acetate

*Canonical Smiles

CC(=O)OC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)OC

*Isomeric Smiles

N/A

*XLogP

2.4

*Topological Polar Surface Area

71.1

[edit] External Links

Link to BIAdb Database