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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H24N2O2.H2O4S
Molecular Weight 422.495
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of QUININE BISULFATE

SMILES

OS(O)(=O)=O.[H][C@]1(C[C@@H]2CC[N@]1C[C@@H]2C=C)[C@H](O)C3=C4C=C(OC)C=CC4=NC=C3

InChI

InChIKey=AKYHKWQPZHDOBW-DSXUQNDKSA-N
InChI=1S/C20H24N2O2.H2O4S/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;1-5(2,3)4/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H2,1,2,3,4)/t13-,14-,19-,20+;/m0./s1

HIDE SMILES / InChI

Molecular Formula H2O4S
Molecular Weight 98.078
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C20H24N2O2
Molecular Weight 324.4168
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 Dec 16 00:23:30 UTC 2023
Edited
by admin
on Sat Dec 16 00:23:30 UTC 2023
Record UNII
M201HC068W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
QUININE BISULFATE
FHFI   WHO-DD  
Common Name English
QUININE, SULFATE (1:1) (SALT)
Common Name English
QUININE BISULFATE ANHYDROUS [MI]
Common Name English
Quinine bisulfate [WHO-DD]
Common Name English
QUININE HYDROGEN SULFATE
Common Name English
ANHYDROUS QUININE BISULFATE
MART.  
Common Name English
QUININE BISULFATE [FHFI]
Common Name English
ANHYDROUS QUININE BISULFATE [MART.]
Common Name English
CINCHONAN-9-OL, 6'-METHOXY-, (8.ALPHA.,9R)-, SULFATE (1:1)
Common Name English
FEMA NO. 2975
Code English
CINCHONAN-9-OL, 6'-METHOXY-, (8.ALPHA.,9R)-, SULFATE (1:1) (SALT)
Common Name English
Classification Tree Code System Code
CFR 21 CFR 310.547
Created by admin on Sat Dec 16 00:23:30 UTC 2023 , Edited by admin on Sat Dec 16 00:23:30 UTC 2023
Code System Code Type Description
RXCUI
9073
Created by admin on Sat Dec 16 00:23:30 UTC 2023 , Edited by admin on Sat Dec 16 00:23:30 UTC 2023
PRIMARY RxNorm
FDA UNII
M201HC068W
Created by admin on Sat Dec 16 00:23:30 UTC 2023 , Edited by admin on Sat Dec 16 00:23:30 UTC 2023
PRIMARY
CAS
549-56-4
Created by admin on Sat Dec 16 00:23:30 UTC 2023 , Edited by admin on Sat Dec 16 00:23:30 UTC 2023
PRIMARY
ChEMBL
CHEMBL170
Created by admin on Sat Dec 16 00:23:30 UTC 2023 , Edited by admin on Sat Dec 16 00:23:30 UTC 2023
PRIMARY
EVMPD
SUB15088MIG
Created by admin on Sat Dec 16 00:23:30 UTC 2023 , Edited by admin on Sat Dec 16 00:23:30 UTC 2023
PRIMARY
CHEBI
52250
Created by admin on Sat Dec 16 00:23:30 UTC 2023 , Edited by admin on Sat Dec 16 00:23:30 UTC 2023
PRIMARY
SMS_ID
100000085674
Created by admin on Sat Dec 16 00:23:30 UTC 2023 , Edited by admin on Sat Dec 16 00:23:30 UTC 2023
PRIMARY
EPA CompTox
DTXSID40889351
Created by admin on Sat Dec 16 00:23:30 UTC 2023 , Edited by admin on Sat Dec 16 00:23:30 UTC 2023
PRIMARY
MERCK INDEX
m9447
Created by admin on Sat Dec 16 00:23:30 UTC 2023 , Edited by admin on Sat Dec 16 00:23:30 UTC 2023
PRIMARY
ECHA (EC/EINECS)
208-970-9
Created by admin on Sat Dec 16 00:23:30 UTC 2023 , Edited by admin on Sat Dec 16 00:23:30 UTC 2023
PRIMARY
PUBCHEM
11949689
Created by admin on Sat Dec 16 00:23:30 UTC 2023 , Edited by admin on Sat Dec 16 00:23:30 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
SOLVATE->ANHYDROUS
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IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
INTERNATIONAL PHARMACOPEIA
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
INTERNATIONAL PHARMACOPEIA
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
INTERNATIONAL PHARMACOPEIA
Related Record Type Details
ACTIVE MOIETY