1,4-Anhydro-1-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-D-glucitol, (1S)-

Details

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

SHOW SMILES / InChI

Structure of 1,4-Anhydro-1-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-D-glucitol, (1S)-

Structure Search

SMILES

[H][C@@]1(O[C@H]([C@H](O)[C@H]1O)C2=CC(CC3=CC=C(OCC)C=C3)=C(Cl)C=C2)[C@H](O)CO

InChI

InChIKey=RRYZEJFQBYDTNH-SSSFQFABSA-N

InChI=1S/C21H25ClO6/c1-2-27-15-6-3-12(4-7-15)9-14-10-13(5-8-16(14)22)20-18(25)19(26)21(28-20)17(24)11-23/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 `Sat Dec 16 19:52:59 GMT 2023` Edited by `admin` on `Sat Dec 16 19:52:59 GMT 2023`
Record UNII	YVU6XK9RBL
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,4-Anhydro-1-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-D-glucitol, (1S)-

Systematic Name

English

Dapagliflozin Furanose Isomer

Common Name

English

(1S)-1,4-Anhydro-1-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-D-glucitol

Systematic Name

English

(2S,3R,4R,5R)-2-(4-chloro-3-(4-ethoxybenzyl)phenyl)-5-((R)-1,2-dihydroxyethyl)tetrahydrofuran-3,4-diol

Systematic Name

English

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

Systematic Name

English

Code System Code Type Description

PUBCHEM

73357151

Created by admin on Sat Dec 16 19:53:00 GMT 2023 , Edited by admin on Sat Dec 16 19:53:00 GMT 2023

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CAS

1469910-70-0

Created by admin on Sat Dec 16 19:53:00 GMT 2023 , Edited by admin on Sat Dec 16 19:53:00 GMT 2023

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FDA UNII

YVU6XK9RBL

Created by admin on Sat Dec 16 19:53:00 GMT 2023 , Edited by admin on Sat Dec 16 19:53:00 GMT 2023

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