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Details

Stereochemistry ABSOLUTE
Molecular Formula C8H14N2O.C4H6O6
Molecular Weight 304.2964
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Pyrazolidinone, 5-cyclopentyl-, (5R)-, (2S,3S)-2,3-dihydroxybutanedioate (1:1)

SMILES

O[C@@H]([C@H](O)C(O)=O)C(O)=O.O=C1C[C@@H](NN1)C2CCCC2

InChI

InChIKey=LMVBBBONHUZZNL-DOIQAPIBSA-N
InChI=1S/C8H14N2O.C4H6O6/c11-8-5-7(9-10-8)6-3-1-2-4-6;5-1(3(7)8)2(6)4(9)10/h6-7,9H,1-5H2,(H,10,11);1-2,5-6H,(H,7,8)(H,9,10)/t7-;1-,2-/m10/s1

HIDE SMILES / InChI

Molecular Formula C8H14N2O
Molecular Weight 154.2096
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula C4H6O6
Molecular Weight 150.0868
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 Wed Apr 02 19:33:58 GMT 2025
Edited
by admin
on Wed Apr 02 19:33:58 GMT 2025
Record UNII
W95ND2V4X8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Pyrazolidinone, 5-cyclopentyl-, (5R)-, (2S,3S)-2,3-dihydroxybutanedioate (1:1)
Preferred Name English
Code System Code Type Description
FDA UNII
W95ND2V4X8
Created by admin on Wed Apr 02 19:33:58 GMT 2025 , Edited by admin on Wed Apr 02 19:33:58 GMT 2025
PRIMARY
PUBCHEM
162334968
Created by admin on Wed Apr 02 19:33:58 GMT 2025 , Edited by admin on Wed Apr 02 19:33:58 GMT 2025
PRIMARY
CAS
2102675-37-4
Created by admin on Wed Apr 02 19:33:58 GMT 2025 , Edited by admin on Wed Apr 02 19:33:58 GMT 2025
PRIMARY
Related Record Type Details
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