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hydroxypioglitazone

PropertiesImage
MNX_IDMNXM156655 Image of MNXM156655
referencechebi:82937
formulaC19H20N2O4S
global charge0
mol weight372.446
InChIKeyOXVFDZYQLGRLCD-UHFFFAOYSA-N
InChIInChI=1S/C19H20N2O4S/c1-12(22)14-4-5-15(20-11-14)8-9-25-16-6-2-13(3-7-16)10-17-18(23)21-19(24)26-17/h2-7,11-12,17,22H,8-10H2,1H3,(H,21,23,24)
SMILESCC(O)C1=CC=C(CCOC2=CC=C(CC3SC(=O)NC3=O)C=C2)N=C1
MNX internals
InChI (mnx)InChI=1/C19H20N2O4S/c1-12(22)14-4-5-15(20-11-14)8-9-25-16-6-2-13(3-7-16)10-17-18(23)21-19(24)26-17/h2-7,11-12,17,22H,8-10H2,1H3,(H,21,23,24)/t12?,17? Image of MNXM156655
SMILES (mnx)[CH3:1][CH:12]([C:14]1=[CH:11][N:20]=[C:15]([CH2:8][CH2:9][O:25][C:16]2=[CH:7][CH:3]=[C:13]([CH2:10][CH:17]3[C:18]([OH:23])=[N:21][C:19](=[O:24])[S:26]3)[CH:2]=[CH:6]2)[CH:5]=[CH:4]1)[OH:22]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:82937
chebi:82937
OXVFDZYQLGRLCD-UHFFFAOYSA-N
hydroxypioglitazone
5-(4-{2-[5-(1-hydroxyethyl)pyridin-2-yl]ethoxy}benzyl)-1,3-thiazolidine-2,4-dione
hmdb:HMDB0253285
OXVFDZYQLGRLCD-UHFFFAOYSA-N
Hydroxypioglitazone
5-[(4-{2-[5-(1-hydroxyethyl)pyridin-2-yl]ethoxy}phenyl)methyl]-1,3-thiazolidine-2,4-dione

kegg.drug:D11603
keggD:D11603
OXVFDZYQLGRLCD-UHFFFAOYSA-N
Leriglitazone (USAN/INN)
1-Hydroxypioglitazone

keggD:M_D11603
secondary/obsolete/fantasy identifier