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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H25ClO6
Molecular Weight 408.873
Optical Activity ( + )
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DAPAGLIFLOZIN

SMILES

CCOC1=CC=C(CC2=C(Cl)C=CC(=C2)[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C1

InChI

InChIKey=JVHXJTBJCFBINQ-ADAARDCZSA-N
InChI=1S/C21H25ClO6/c1-2-27-15-6-3-12(4-7-15)9-14-10-13(5-8-16(14)22)21-20(26)19(25)18(24)17(11-23)28-21/h3-8,10,17-21,23-26H,2,9,11H2,1H3/t17-,18-,19+,20-,21+/m1/s1

HIDE SMILES / InChI

Molecular Formula C21H25ClO6
Molecular Weight 408.873
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:55:11 UTC 2023
Edited
by admin
on Fri Dec 15 16:55:11 UTC 2023
Record UNII
1ULL0QJ8UC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DAPAGLIFLOZIN
DASH   INN   MI   USAN   VANDF   WHO-DD  
INN   USAN  
Official Name English
DAPAGLIFLOZIN [MI]
Common Name English
QTERNMET XR COMPONENT DAPAGLIFLOZIN
Brand Name English
LYN-045
Code English
Dapagliflozin [WHO-DD]
Common Name English
DAPAGLIFLOZIN COMPONENT QTERNMET
Brand Name English
QTERNMET COMPONENT DAPAGLIFOZIN
Common Name English
(2S,3R,4R,5S,6R)-2-[4-Chloro-3-(4-ethoxybenzyl)phenyl]-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
Systematic Name English
DAPAGLIFLOZIN [USAN]
Common Name English
DAPAGLIFLOZIN [ORANGE BOOK]
Common Name English
D-GLUCITOL, 1,5-ANHYDRO-1-C-(4-CHLORO-3-((4-ETHOXYPHENYL)METHYL)PHENYL)-, (1S)-
Systematic Name English
DAPAGLIFLOZIN COMPONENT OF QTERNMET XR
Brand Name English
dapagliflozin [INN]
Common Name English
DAPAGLIFLOZIN [VANDF]
Common Name English
BMS-512148
Code English
Classification Tree Code System Code
WHO-ATC A10BD25
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
NDF-RT N0000187059
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
WHO-ATC A10BK01
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
NCI_THESAURUS C98083
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
WHO-VATC QA10BD15
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
WHO-ATC A10BX09
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
WHO-ATC A10BD15
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
WHO-VATC QA10BX09
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
WHO-ATC A10BD21
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
Code System Code Type Description
DAILYMED
1ULL0QJ8UC
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
EVMPD
SUB31650
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
NDF-RT
N0000187058
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY Sodium-Glucose Transporter 2 Inhibitors [MoA]
USAN
SS-83
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
WIKIPEDIA
Dapagliflozin
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
CHEBI
85078
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
DRUG BANK
DB06292
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
EPA CompTox
DTXSID20905104
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
RXCUI
1488564
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY RxNorm
DRUG CENTRAL
4304
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
LACTMED
Dapagliflozin
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
MERCK INDEX
m4086
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY Merck Index
MESH
C529054
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
ChEMBL
CHEMBL429910
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
NCI_THESAURUS
C78126
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
FDA UNII
1ULL0QJ8UC
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
IUPHAR
4594
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
CAS
461432-26-8
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
PUBCHEM
9887712
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
SMS_ID
100000124178
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
INN
8886
Created by admin on Fri Dec 15 16:55:11 UTC 2023 , Edited by admin on Fri Dec 15 16:55:11 UTC 2023
PRIMARY
Related Record Type Details
SOLVATE->ANHYDROUS
SOLVATE->ANHYDROUS
TRANSPORTER -> SUBSTRATE
SALT/SOLVATE -> PARENT
SOLVATE->ANHYDROUS
BINDER->LIGAND
BINDING
SALT/SOLVATE -> PARENT
EXCRETED UNCHANGED
URINE
SALT/SOLVATE -> PARENT
Related Record Type Details
METABOLITE INACTIVE -> PARENT
MAJOR
FECAL; PLASMA; URINE
METABOLITE INACTIVE -> PARENT
MAJOR
METABOLITE -> PARENT
MINOR
Related Record Type Details
ACTIVE MOIETY
Name Property Type Amount Referenced Substance Defining Parameters References
Volume of Distribution PHARMACOKINETIC
Tmax PHARMACOKINETIC ORAL ADMINISTRATION

DOSE

FASTED STATE

Biological Half-life PHARMACOKINETIC