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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H24ClFO7
Molecular Weight 454.873
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HENAGLIFLOZIN

SMILES

CCOC1=CC=C(CC2=CC(=CC=C2Cl)[C@@]34OC[C@@](CO)(O3)[C@@H](O)[C@H](O)[C@H]4O)C=C1F

InChI

InChIKey=HYTPDMFFHVZBOR-VNXMGFANSA-N
InChI=1S/C22H24ClFO7/c1-2-29-17-6-3-12(8-16(17)24)7-13-9-14(4-5-15(13)23)22-20(28)18(26)19(27)21(10-25,31-22)11-30-22/h3-6,8-9,18-20,25-28H,2,7,10-11H2,1H3/t18-,19-,20+,21+,22+/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H24ClFO7
Molecular Weight 454.873
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 16:57:18 UTC 2023
Edited
by admin
on Fri Dec 15 16:57:18 UTC 2023
Record UNII
21P2M98388
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HENAGLIFLOZIN
Common Name English
SHR-3824
Code English
Henagliflozin [WHO-DD]
Common Name English
SHR3824
Code English
.BETA.-D-GLUCOPYRANOSE, 1,6-ANHYDRO-1-C-(4-CHLORO-3-((4-ETHOXY-3-FLUOROPHENYL)METHYL)PHENYL)-5-C-(HYDROXYMETHYL)-
Systematic Name English
((1R,2S,3S,4R,5R)-5-(4-CHLORO-3-(4-ETHOXY-3-FLUOROBENZYL)PHENYL)-1-(HYDROXYMETHYL)-6,8-DIOXABICYCLO(3.2.1)OCTANE-2,3,4-TRIOL
Systematic Name English
Code System Code Type Description
FDA UNII
21P2M98388
Created by admin on Fri Dec 15 16:57:18 UTC 2023 , Edited by admin on Fri Dec 15 16:57:18 UTC 2023
PRIMARY
PUBCHEM
56832738
Created by admin on Fri Dec 15 16:57:18 UTC 2023 , Edited by admin on Fri Dec 15 16:57:18 UTC 2023
PRIMARY
DRUG BANK
DB11939
Created by admin on Fri Dec 15 16:57:18 UTC 2023 , Edited by admin on Fri Dec 15 16:57:18 UTC 2023
PRIMARY
CAS
1623804-44-3
Created by admin on Fri Dec 15 16:57:18 UTC 2023 , Edited by admin on Fri Dec 15 16:57:18 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
SALT/SOLVATE -> PARENT
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ACTIVE MOIETY