Dapagliflozin Open Ring

Details

Stereochemistry	EPIMERIC
Molecular Formula	C21H27ClO7
Molecular Weight	426.888
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=QXLZASULNNCSEF-WNTWWTRPSA-N

InChI=1S/C21H27ClO7/c1-2-29-15-6-3-12(4-7-15)9-14-10-13(5-8-16(14)22)18(25)20(27)21(28)19(26)17(24)11-23/h3-8,10,17-21,23-28H,2,9,11H2,1H3/t17-,18?,19-,20+,21+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H27ClO7
Molecular Weight	426.888
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	4 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:37:59 GMT 2025` Edited by `admin` on `Wed Apr 02 17:37:59 GMT 2025`
Record UNII	6C9NSJ2ZND
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Dapagliflozin Open Ring

Common Name

English

1-C-[4-Chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-D-glucitol

Preferred Name

English

D-Glucitol, 1-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-

Systematic Name

English

Code System Code Type Description

CAS

2100872-88-4

Created by admin on Wed Apr 02 17:37:59 GMT 2025 , Edited by admin on Wed Apr 02 17:37:59 GMT 2025

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FDA UNII

6C9NSJ2ZND

Created by admin on Wed Apr 02 17:37:59 GMT 2025 , Edited by admin on Wed Apr 02 17:37:59 GMT 2025

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PUBCHEM

145714365

Created by admin on Wed Apr 02 17:37:59 GMT 2025 , Edited by admin on Wed Apr 02 17:37:59 GMT 2025

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