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Details

Stereochemistry ABSOLUTE
Molecular Formula C6H14N2.C2O4.Pt
Molecular Weight 397.292
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0
Stereo Comments SP4.2

SHOW SMILES / InChI
Structure of OXALIPLATIN, (S,S)-

SMILES

[Pt++].[O-]C(=O)C([O-])=O.N[C@H]1CCCC[C@@H]1N

InChI

InChIKey=ZROHGHOFXNOHSO-USPAICOZSA-L
InChI=1S/C6H14N2.C2H2O4.Pt/c7-5-3-1-2-4-6(5)8;3-1(4)2(5)6;/h5-6H,1-4,7-8H2;(H,3,4)(H,5,6);/q;;+2/p-2/t5-,6-;;/m0../s1

HIDE SMILES / InChI

Molecular Formula Pt
Molecular Weight 195.084
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C2O4
Molecular Weight 88.019
Charge -2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C6H14N2
Molecular Weight 114.1888
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 09:49:14 UTC 2023
Edited
by admin
on Sat Dec 16 09:49:14 UTC 2023
Record UNII
EDV9R3J9FW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OXALIPLATIN, (S,S)-
Common Name English
OXALIPLATIN IMPURITY D [EP IMPURITY]
Common Name English
(CIS-((1S,2S)-1,2-CYCLOHEXANEDIAMINE-N,N')(OXALATO(2-)-O,O')PLATINUM)
Common Name English
OXALIPLATIN RELATED COMPOUND D
USP-RS  
Common Name English
NSC-266042
Code English
PLATINUM, ((1S,2S)-1,2-CYCLOHEXANEDIAMINE-.KAPPA.N1,.KAPPA.N2)(ETHANEDIOATO(2-)-.KAPPA.O1,.KAPPA.O2)-
Systematic Name English
OXALIPLATIN RELATED COMPOUND D [USP-RS]
Common Name English
OXALIPLATIN RELATED COMPOUND D [USP IMPURITY]
Common Name English
Code System Code Type Description
CAS
61758-77-8
Created by admin on Sat Dec 16 09:49:14 UTC 2023 , Edited by admin on Sat Dec 16 09:49:14 UTC 2023
PRIMARY
PUBCHEM
15057790
Created by admin on Sat Dec 16 09:49:14 UTC 2023 , Edited by admin on Sat Dec 16 09:49:14 UTC 2023
PRIMARY
EPA CompTox
DTXSID30977337
Created by admin on Sat Dec 16 09:49:14 UTC 2023 , Edited by admin on Sat Dec 16 09:49:14 UTC 2023
PRIMARY
RS_ITEM_NUM
1481248
Created by admin on Sat Dec 16 09:49:14 UTC 2023 , Edited by admin on Sat Dec 16 09:49:14 UTC 2023
PRIMARY
FDA UNII
EDV9R3J9FW
Created by admin on Sat Dec 16 09:49:14 UTC 2023 , Edited by admin on Sat Dec 16 09:49:14 UTC 2023
PRIMARY
NSC
266042
Created by admin on Sat Dec 16 09:49:14 UTC 2023 , Edited by admin on Sat Dec 16 09:49:14 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
limites not given
EP