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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H24N2O2.C7H6O3
Molecular Weight 462.5385
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of QUININE SALICYLATE

SMILES

C=C[C@@]1([H])CN2CC[C@@]1([H])C[C@@]2([H])[C@@]([H])(c3ccnc4ccc(cc34)OC)O.c1ccc(c(c1)C(=O)O)O

InChI

InChIKey=MAYUSTFJKJSJNC-DSXUQNDKSA-N
InChI=1S/C20H24N2O2.C7H6O3/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;8-6-4-2-1-3-5(6)7(9)10/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;1-4,8H,(H,9,10)/t13-,14-,19-,20+;/m0./s1

HIDE SMILES / InChI

Molecular Formula C7H6O3
Molecular Weight 138.121
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C20H24N2O2
Molecular Weight 324.4175
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 08:26:21 UTC 2021
Edited
by admin
on Sat Jun 26 08:26:21 UTC 2021
Record UNII
6DY04L71DR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
QUININE SALICYLATE
WHO-DD  
Common Name English
CHININUM SALICYLICUM
HPUS  
Common Name English
CINCHONAN-9-OL, 6'-METHOXY-, (8.ALPHA.,9R)-, 2-HYDROXYBENZOATE (1:1)
Common Name English
QUININE SALICYLATE [WHO-DD]
Common Name English
QUININE, MONOSALICYLATE
Common Name English
CHININUM SALICYLICUM [HPUS]
Common Name English
Classification Tree Code System Code
CFR 21 CFR 310.547
Created by admin on Sat Jun 26 08:26:22 UTC 2021 , Edited by admin on Sat Jun 26 08:26:22 UTC 2021
Code System Code Type Description
ChEMBL
CHEMBL170
Created by admin on Sat Jun 26 08:26:22 UTC 2021 , Edited by admin on Sat Jun 26 08:26:22 UTC 2021
PRIMARY
PUBCHEM
71794
Created by admin on Sat Jun 26 08:26:22 UTC 2021 , Edited by admin on Sat Jun 26 08:26:22 UTC 2021
PRIMARY
ECHA (EC/EINECS)
212-027-7
Created by admin on Sat Jun 26 08:26:22 UTC 2021 , Edited by admin on Sat Jun 26 08:26:22 UTC 2021
PRIMARY
RXCUI
1426899
Created by admin on Sat Jun 26 08:26:22 UTC 2021 , Edited by admin on Sat Jun 26 08:26:22 UTC 2021
PRIMARY RxNorm
CAS
750-90-3
Created by admin on Sat Jun 26 08:26:22 UTC 2021 , Edited by admin on Sat Jun 26 08:26:22 UTC 2021
PRIMARY
EVMPD
SUB15094MIG
Created by admin on Sat Jun 26 08:26:22 UTC 2021 , Edited by admin on Sat Jun 26 08:26:22 UTC 2021
PRIMARY
FDA UNII
6DY04L71DR
Created by admin on Sat Jun 26 08:26:22 UTC 2021 , Edited by admin on Sat Jun 26 08:26:22 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE
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ACTIVE MOIETY
ACTIVE MOIETY