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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H26ClN3.2H3O4P
Molecular Weight 515.863
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CHLOROQUINE DIPHOSPHATE, (R)-

SMILES

OP(O)(O)=O.OP(O)(O)=O.CCN(CC)CCC[C@@H](C)NC1=CC=NC2=C1C=CC(Cl)=C2

InChI

InChIKey=QKICWELGRMTQCR-FMOMHUKBSA-N
InChI=1S/C18H26ClN3.2H3O4P/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18;2*1-5(2,3)4/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21);2*(H3,1,2,3,4)/t14-;;/m1../s1

HIDE SMILES / InChI

Molecular Formula C18H26ClN3
Molecular Weight 319.872
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula H3O4P
Molecular Weight 97.9952
Charge 0
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 10:49:06 GMT 2023
Edited
by admin
on Sat Dec 16 10:49:06 GMT 2023
Record UNII
KPK76IHN3V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CHLOROQUINE DIPHOSPHATE, (R)-
Common Name English
1,4-PENTANEDIAMINE, N4-(7-CHLORO-4-QUINOLINYL)-N1,N1-DIETHYL-, (4R)-, PHOSPHATE, (R)-
Systematic Name English
(-)-CHLOROQUINE DIPHOSPHATE
Code English
Code System Code Type Description
EPA CompTox
DTXSID70986726
Created by admin on Sat Dec 16 10:49:06 GMT 2023 , Edited by admin on Sat Dec 16 10:49:06 GMT 2023
PRIMARY
PUBCHEM
73415915
Created by admin on Sat Dec 16 10:49:06 GMT 2023 , Edited by admin on Sat Dec 16 10:49:06 GMT 2023
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DAILYMED
KPK76IHN3V
Created by admin on Sat Dec 16 10:49:06 GMT 2023 , Edited by admin on Sat Dec 16 10:49:06 GMT 2023
PRIMARY
RXCUI
2593903
Created by admin on Sat Dec 16 10:49:06 GMT 2023 , Edited by admin on Sat Dec 16 10:49:06 GMT 2023
PRIMARY
FDA UNII
KPK76IHN3V
Created by admin on Sat Dec 16 10:49:06 GMT 2023 , Edited by admin on Sat Dec 16 10:49:06 GMT 2023
PRIMARY
CAS
67459-54-5
Created by admin on Sat Dec 16 10:49:06 GMT 2023 , Edited by admin on Sat Dec 16 10:49:06 GMT 2023
PRIMARY