U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry MIXED
Molecular Formula C6H14N2.C3H4O3.Pt
Molecular Weight 397.335
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0
Stereo Comments CYCLOBUTANE ORIENTATION RESULTS IN DIASTEREOISOMERS

SHOW SMILES / InChI
Structure of LOBAPLATIN

SMILES

[Pt++].C[C@H]([O-])C([O-])=O.NC[C@@H]1CC[C@H]1CN

InChI

InChIKey=RLXPIABKJFUYFG-DOYDWZMXSA-M
InChI=1S/C6H14N2.C3H5O3.Pt/c7-3-5-1-2-6(5)4-8;1-2(4)3(5)6;/h5-6H,1-4,7-8H2;2H,1H3,(H,5,6);/q;-1;+2/p-1/t5-,6-;2-;/m00./s1

HIDE SMILES / InChI

Molecular Formula C3H4O3
Molecular Weight 88.0621
Charge -2
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

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 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 Fri Dec 15 16:15:15 GMT 2023
Edited
by admin
on Fri Dec 15 16:15:15 GMT 2023
Record UNII
OX5XK1JD8C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LOBAPLATIN
INN   MART.   MI   WHO-DD  
INN  
Official Name English
LOBAPLATIN [MART.]
Common Name English
Lobaplatin [WHO-DD]
Common Name English
lobaplatin [INN]
Common Name English
NSC-741422
Code English
CIS-(TRANS-1,2-CYCLOBUTANEBIS(METHYLAMINE))((S)-LACTATO-O1,O1)PLATINUM
Common Name English
LOBAPLATIN [MI]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C1450
Created by admin on Fri Dec 15 16:15:15 GMT 2023 , Edited by admin on Fri Dec 15 16:15:15 GMT 2023
Code System Code Type Description
SMS_ID
100000082547
Created by admin on Fri Dec 15 16:15:15 GMT 2023 , Edited by admin on Fri Dec 15 16:15:15 GMT 2023
PRIMARY
NCI_THESAURUS
C1434
Created by admin on Fri Dec 15 16:15:15 GMT 2023 , Edited by admin on Fri Dec 15 16:15:15 GMT 2023
PRIMARY
EVMPD
SUB08540MIG
Created by admin on Fri Dec 15 16:15:15 GMT 2023 , Edited by admin on Fri Dec 15 16:15:15 GMT 2023
PRIMARY
INN
6790
Created by admin on Fri Dec 15 16:15:15 GMT 2023 , Edited by admin on Fri Dec 15 16:15:15 GMT 2023
PRIMARY
DRUG BANK
DB13049
Created by admin on Fri Dec 15 16:15:15 GMT 2023 , Edited by admin on Fri Dec 15 16:15:15 GMT 2023
PRIMARY
MERCK INDEX
m6877
Created by admin on Fri Dec 15 16:15:15 GMT 2023 , Edited by admin on Fri Dec 15 16:15:15 GMT 2023
PRIMARY Merck Index
FDA UNII
OX5XK1JD8C
Created by admin on Fri Dec 15 16:15:15 GMT 2023 , Edited by admin on Fri Dec 15 16:15:15 GMT 2023
PRIMARY
CAS
135558-11-1
Created by admin on Fri Dec 15 16:15:15 GMT 2023 , Edited by admin on Fri Dec 15 16:15:15 GMT 2023
PRIMARY
CAS
131374-93-1
Created by admin on Fri Dec 15 16:15:15 GMT 2023 , Edited by admin on Fri Dec 15 16:15:15 GMT 2023
ALTERNATIVE
MESH
C066228
Created by admin on Fri Dec 15 16:15:15 GMT 2023 , Edited by admin on Fri Dec 15 16:15:15 GMT 2023
PRIMARY
NSC
741422
Created by admin on Fri Dec 15 16:15:15 GMT 2023 , Edited by admin on Fri Dec 15 16:15:15 GMT 2023
PRIMARY
PUBCHEM
10000860
Created by admin on Fri Dec 15 16:15:15 GMT 2023 , Edited by admin on Fri Dec 15 16:15:15 GMT 2023
PRIMARY
EPA CompTox
DTXSID50929050
Created by admin on Fri Dec 15 16:15:15 GMT 2023 , Edited by admin on Fri Dec 15 16:15:15 GMT 2023
PRIMARY
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