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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H23N5O6S
Molecular Weight 425.459
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(((7S,9AS)-OCTAHYDRO-2-(5-(SULFOOXY)-2-PYRIMIDINYL)-2H-PYRIDO(1,2-A)PYRAZIN-7-YL)METHYL)-2,5-PYRROLIDINEDIONE

SMILES

[H][C@@]12CC[C@H](CN3C(=O)CCC3=O)CN1CCN(C2)C4=NC=C(OS(O)(=O)=O)C=N4

InChI

InChIKey=WUVVAHHGDGJIRL-STQMWFEESA-N
InChI=1S/C17H23N5O6S/c23-15-3-4-16(24)22(15)10-12-1-2-13-11-21(6-5-20(13)9-12)17-18-7-14(8-19-17)28-29(25,26)27/h7-8,12-13H,1-6,9-11H2,(H,25,26,27)/t12-,13-/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H23N5O6S
Molecular Weight 425.459
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:26:38 UTC 2023
Edited
by admin
on Sat Dec 16 16:26:38 UTC 2023
Record UNII
8DH5AL16Z8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(((7S,9AS)-OCTAHYDRO-2-(5-(SULFOOXY)-2-PYRIMIDINYL)-2H-PYRIDO(1,2-A)PYRAZIN-7-YL)METHYL)-2,5-PYRROLIDINEDIONE
Systematic Name English
2,5-PYRROLIDINEDIONE, 1-(((7S,9AS)-OCTAHYDRO-2-(5-(SULFOOXY)-2-PYRIMIDINYL)-2H-PYRIDO(1,2-A)PYRAZIN-7-YL)METHYL)-
Systematic Name English
CP-93,393 METABOLITE M13
Common Name English
2,5-PYRROLIDINEDIONE, 1-((OCTAHYDRO-2-(5-(SULFOOXY)-2-PYRIMIDINYL)-2H-PYRIDO(1,2-A)PYRAZIN-7-YL)METHYL)-, (7S-TRANS)-
Systematic Name English
Code System Code Type Description
PUBCHEM
154731591
Created by admin on Sat Dec 16 16:26:38 UTC 2023 , Edited by admin on Sat Dec 16 16:26:38 UTC 2023
PRIMARY
FDA UNII
8DH5AL16Z8
Created by admin on Sat Dec 16 16:26:38 UTC 2023 , Edited by admin on Sat Dec 16 16:26:38 UTC 2023
PRIMARY
CAS
202518-33-0
Created by admin on Sat Dec 16 16:26:38 UTC 2023 , Edited by admin on Sat Dec 16 16:26:38 UTC 2023
PRIMARY
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