O-Pentaacetyl O-Desethyl Dapagliflozin

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H31ClO11
Molecular Weight	591.003
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of O-Pentaacetyl O-Desethyl Dapagliflozin

Structure Search

SMILES

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

InChI

InChIKey=SDZNDOYQCYOLJI-ZCCUTQAASA-N

InChI=1S/C29H31ClO11/c1-15(31)36-14-25-27(38-17(3)33)29(40-19(5)35)28(39-18(4)34)26(41-25)21-8-11-24(30)22(13-21)12-20-6-9-23(10-7-20)37-16(2)32/h6-11,13,25-29H,12,14H2,1-5H3/t25-,26+,27-,28+,29+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C29H31ClO11
Molecular Weight	591.003
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 `Wed Apr 02 19:22:38 GMT 2025` Edited by `admin` on `Wed Apr 02 19:22:38 GMT 2025`
Record UNII	DRJ9SLB6UK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(2S,3S,4R,5R,6R)-2-(3-(4-Acetoxybenzyl)-4-chlorophenyl)-6-(acetoxymethyl)tetrahydro-2H-pyran-3,4,5-triyl triacetate

Preferred Name

English

O-Pentaacetyl O-Desethyl Dapagliflozin

Common Name

English

D-Glucitol, 1-C-[3-[[4-(acetyloxy)phenyl]methyl]-4-chlorophenyl]-1,5-anhydro-, 2,3,4,6-tetraacetate, (1S)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

59167842

Created by admin on Wed Apr 02 19:22:38 GMT 2025 , Edited by admin on Wed Apr 02 19:22:38 GMT 2025

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FDA UNII

DRJ9SLB6UK

Created by admin on Wed Apr 02 19:22:38 GMT 2025 , Edited by admin on Wed Apr 02 19:22:38 GMT 2025

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CAS

912917-85-2

Created by admin on Wed Apr 02 19:22:38 GMT 2025 , Edited by admin on Wed Apr 02 19:22:38 GMT 2025

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