1,5-Anhydro-1-C-[3-[[5-(4-fluorophenyl)-2-thienyl]methyl]-4-methylphenyl]-D-glucitol 2,3,4,6-tetraacetate, (1S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C32H33FO9S
Molecular Weight	612.662
Optical Activity	( - )
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,5-Anhydro-1-C-[3-[[5-(4-fluorophenyl)-2-thienyl]methyl]-4-methylphenyl]-D-glucitol 2,3,4,6-tetraacetate, (1S)-

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(S3)C4=CC=C(F)C=C4)=C(C)C=C2

InChI

InChIKey=XYBGJUIUCFENGS-IFUGWHCZSA-N

InChI=1S/C32H33FO9S/c1-17-6-7-23(14-24(17)15-26-12-13-28(43-26)22-8-10-25(33)11-9-22)29-31(40-20(4)36)32(41-21(5)37)30(39-19(3)35)27(42-29)16-38-18(2)34/h6-14,27,29-32H,15-16H2,1-5H3/t27-,29+,30-,31+,32+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C32H33FO9S
Molecular Weight	612.662
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 19:44:20 GMT 2025` Edited by `admin` on `Wed Apr 02 19:44:20 GMT 2025`
Record UNII	UBS5P45257
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

(1S)-1,5-Anhydro-1-C-[3-[[5-(4-fluorophenyl)-2-thienyl]methyl]-4-methylphenyl]-D-glucitol 2,3,4,6-tetraacetate

Preferred Name

English

1,5-Anhydro-1-C-[3-[[5-(4-fluorophenyl)-2-thienyl]methyl]-4-methylphenyl]-D-glucitol 2,3,4,6-tetraacetate, (1S)-

Systematic Name

English

D-Glucitol, 1,5-anhydro-1-C-[3-[[5-(4-fluorophenyl)-2-thienyl]methyl]-4-methylphenyl]-, 2,3,4,6-tetraacetate, (1S)-

Systematic Name

English

D-Glucitol, 1,5-anhydro-1-C-[3-[[5-(4-fluorophenyl)-2-thienyl]methyl]-4-methylphenyl]-, tetraacetate, (1S)-

Systematic Name

English

Code System Code Type Description

CAS

866607-35-4

Created by admin on Wed Apr 02 19:44:20 GMT 2025 , Edited by admin on Wed Apr 02 19:44:20 GMT 2025

PRIMARY

PUBCHEM

25224976

Created by admin on Wed Apr 02 19:44:20 GMT 2025 , Edited by admin on Wed Apr 02 19:44:20 GMT 2025

PRIMARY

EPA CompTox

DTXSID501045094

Created by admin on Wed Apr 02 19:44:20 GMT 2025 , Edited by admin on Wed Apr 02 19:44:20 GMT 2025

PRIMARY

FDA UNII

UBS5P45257

Created by admin on Wed Apr 02 19:44:20 GMT 2025 , Edited by admin on Wed Apr 02 19:44:20 GMT 2025

PRIMARY