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Details

Stereochemistry MIXED
Molecular Formula C18H18FNO2S
Molecular Weight 331.404
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0
Stereo Comments Assumed mixed

SHOW SMILES / InChI
Structure of PRASUGREL DESACETYL

SMILES

FC1=CC=CC=C1C(N2CCC3SC(=O)C=C3C2)C(=O)C4CC4

InChI

InChIKey=MJAMUSZUMAHFLH-UHFFFAOYSA-N
InChI=1S/C18H18FNO2S/c19-14-4-2-1-3-13(14)17(18(22)11-5-6-11)20-8-7-15-12(10-20)9-16(21)23-15/h1-4,9,11,15,17H,5-8,10H2

HIDE SMILES / InChI

Molecular Formula C18H18FNO2S
Molecular Weight 331.404
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 10:32:32 UTC 2023
Edited
by admin
on Sat Dec 16 10:32:32 UTC 2023
Record UNII
1F19E6097Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PRASUGREL DESACETYL
Common Name English
DESACETYL PRASUGREL DIASTEREOMER 2 COMPONENT OF DESACETYL PRASUGREL
Common Name English
DESACETYL PRASUGREL DIASTEREOMER 1 COMPONENT OF DESACETYL PRASUGREL
Common Name English
DESACETYL PRASUGREL
Common Name English
THIENO(3,2-C)PYRIDIN-2(4H)-ONE, 5-(2-CYCLOPROPYL-1-(2-FLUOROPHENYL)-2-OXOETHYL)-5,6,7,7A-TETRAHYDRO-
Systematic Name English
R-95913
Code English
5-(2-CYCLOPROPYL-1-(2-FLUOROPHENYL)-2-OXOETHYL)-5,6,7,7A-TETRAHYDROTHIENO(3,2-C)PYRIDIN-2(4H)-ONE
Systematic Name English
Code System Code Type Description
CAS
150322-38-6
Created by admin on Sat Dec 16 10:32:32 UTC 2023 , Edited by admin on Sat Dec 16 10:32:32 UTC 2023
PRIMARY
EPA CompTox
DTXSID00465251
Created by admin on Sat Dec 16 10:32:32 UTC 2023 , Edited by admin on Sat Dec 16 10:32:32 UTC 2023
PRIMARY
PUBCHEM
11416277
Created by admin on Sat Dec 16 10:32:32 UTC 2023 , Edited by admin on Sat Dec 16 10:32:32 UTC 2023
PRIMARY
RS_ITEM_NUM
1554148
Created by admin on Sat Dec 16 10:32:32 UTC 2023 , Edited by admin on Sat Dec 16 10:32:32 UTC 2023
PRIMARY
FDA UNII
1F19E6097Q
Created by admin on Sat Dec 16 10:32:32 UTC 2023 , Edited by admin on Sat Dec 16 10:32:32 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE INACTIVE
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PARENT -> IMPURITY
ASSAY (HPLC)
USP