Thiocholchicine

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Thiocholchicine
Systematic (IUPAC) name
N-[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[d]heptalen-7-yl]acetamide
Identifiers
CAS number  ?
ATC code  ?
PubChem 17648
Chemical data
Formula C22H25NO5S
Mol. mass 415.5026
SMILES eMolecules & PubChem
Pharmacokinetic data
Bioavailability  ?
Metabolism  ?
Half life  ?
Excretion  ?
Therapeutic considerations
Pregnancy cat.

?

Legal status
Routes  ?

Description

RN refers to (S)-isomer

General Properties

*Molecular Weight

415.5026

*Molecular Formula

C22H25NO5S

*IUPAC NAME

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

*Canonical Smiles

CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)OC

*Isomeric Smiles

CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)OC

*XLogP

1.9

*Topological Polar Surface Area

73.9

External Links

Link to BIAdb Database