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Details

Stereochemistry MIXED
Molecular Formula C18H18FNO3S
Molecular Weight 347.404
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0
Stereo Comments Assumed mixed

SHOW SMILES / InChI
Structure of DESACETYL HYDROXYPRASUGREL

SMILES

OC12CCN(CC1=CC(=O)S2)C(C(=O)C3CC3)C4=CC=CC=C4F

InChI

InChIKey=OHANBBNBMKFHBI-UHFFFAOYSA-N
InChI=1S/C18H18FNO3S/c19-14-4-2-1-3-13(14)16(17(22)11-5-6-11)20-8-7-18(23)12(10-20)9-15(21)24-18/h1-4,9,11,16,23H,5-8,10H2

HIDE SMILES / InChI

Molecular Formula C18H18FNO3S
Molecular Weight 347.404
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:32:33 UTC 2023
Edited
by admin
on Sat Dec 16 10:32:33 UTC 2023
Record UNII
OJ1QGJ5J3O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DESACETYL HYDROXYPRASUGREL
Common Name English
DESACETYL HYDROXYPRASUGREL [USP IMPURITY]
Common Name English
THIENO(3,2-C)PYRIDIN-2(4H)-ONE, 5-(2-CYCLOPROPYL-1-(2-FLUOROPHENYL)-2-OXOETHYL)-5,6,7,7A-TETRAHYDRO-7A-HYDROXY-
Systematic Name English
5-(2-CYCLOPROPYL-1-(2-FLUOROPHENYL)-2-OXOETHYL)-5,6,7,7A-TETRAHYDRO-7A-HYDROXYTHIENO(3,2-C)PYRIDIN-2(4H)-ONE
Systematic Name English
Code System Code Type Description
CAS
947502-66-1
Created by admin on Sat Dec 16 10:32:34 UTC 2023 , Edited by admin on Sat Dec 16 10:32:34 UTC 2023
PRIMARY
PUBCHEM
59407287
Created by admin on Sat Dec 16 10:32:34 UTC 2023 , Edited by admin on Sat Dec 16 10:32:34 UTC 2023
PRIMARY
FDA UNII
OJ1QGJ5J3O
Created by admin on Sat Dec 16 10:32:34 UTC 2023 , Edited by admin on Sat Dec 16 10:32:34 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP