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Details

Stereochemistry ABSOLUTE
Molecular Formula C6H14N2.C2O4.Pt.2HO
Molecular Weight 431.306
Optical Activity UNSPECIFIED
Additional Stereochemistry Yes
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0
Stereo Comments SQUARE PLANAR, CIS-

SHOW SMILES / InChI
Structure of DIHYDROXY OXALIPLATIN-PT(IV)

SMILES

[OH-].[OH-].[Pt+4].[O-]C(=O)C([O-])=O.[H][C@@]1(N)CCCC[C@@]1([H])N

InChI

InChIKey=CRUOOYJLGQUXMM-NDSUJOINSA-J
InChI=1S/C6H14N2.C2H2O4.2H2O.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);2*1H2;/q;;;;+4/p-4/t5-,6-;;;;/m1..../s1

HIDE SMILES / InChI

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

Molecular Formula Pt
Molecular Weight 195.084
Charge 4
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula HO
Molecular Weight 17.0073
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:16:46 UTC 2023
Edited
by admin
on Sat Dec 16 09:16:46 UTC 2023
Record UNII
AXA37HSS7Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIHYDROXY OXALIPLATIN-PT(IV)
Common Name English
(OC-6-33)-((1R,2R)-CYCLOHEXANE-1,2-DIAMINE.KAPPA.N,.KAPPA.N')(ETHANEDIOATO(2-)-.KAPPA.O1,.KAPPA.O2)DIHYDROXYPLATINUM
Systematic Name English
OXALIPLATIN RELATED COMPOUND C
Common Name English
OXALIPLATIN IMPURITY C [EP IMPURITY]
Common Name English
((1R-TRANS-(1,2-CYCLOHEXANEDIAMINE-N,N'))-TRANS-DIHYDROXIDO-(OXALATO(2-)-O,O')PLATINUM(IV))
Common Name English
OXALIPLATIN RELATED COMPOUND C [USP IMPURITY]
Common Name English
PLATINUM, ((1R,2R)-1,2-CYCLOHEXANEDIAMINE-.KAPPA.N1,.KAPPA.N2)(ETHANEDIOATO(2-)-.KAPPA.O1,.KAPPA.O2)DIHYDROXY-, (OC-6-33)-
Systematic Name English
Code System Code Type Description
CAS
111321-67-6
Created by admin on Sat Dec 16 09:16:46 UTC 2023 , Edited by admin on Sat Dec 16 09:16:46 UTC 2023
PRIMARY
EPA CompTox
DTXSID60747681
Created by admin on Sat Dec 16 09:16:46 UTC 2023 , Edited by admin on Sat Dec 16 09:16:46 UTC 2023
PRIMARY
FDA UNII
AXA37HSS7Z
Created by admin on Sat Dec 16 09:16:46 UTC 2023 , Edited by admin on Sat Dec 16 09:16:46 UTC 2023
PRIMARY
PUBCHEM
129011603
Created by admin on Sat Dec 16 09:16:46 UTC 2023 , Edited by admin on Sat Dec 16 09:16:46 UTC 2023
PRIMARY
RS_ITEM_NUM
1481237
Created by admin on Sat Dec 16 09:16:46 UTC 2023 , Edited by admin on Sat Dec 16 09:16:46 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP