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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H30N2O13S
Molecular Weight 586.566
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N4-.BETA.-D-GLUCOSYLSULFANILAMIDE N,N',2,3,4,6-HEXAACETATE

SMILES

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)N([C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)C(C)=O

InChI

InChIKey=HJAYHQKESVDQDQ-GNADVCDUSA-N
InChI=1S/C24H30N2O13S/c1-12(27)25-40(33,34)19-9-7-18(8-10-19)26(13(2)28)24-23(38-17(6)32)22(37-16(5)31)21(36-15(4)30)20(39-24)11-35-14(3)29/h7-10,20-24H,11H2,1-6H3,(H,25,27)/t20-,21-,22+,23-,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula C24H30N2O13S
Molecular Weight 586.566
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 08:45:20 GMT 2023
Edited
by admin
on Sat Dec 16 08:45:20 GMT 2023
Record UNII
058XUH0IY1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N4-.BETA.-D-GLUCOSYLSULFANILAMIDE N,N',2,3,4,6-HEXAACETATE
MI  
Common Name English
4-(.BETA.-D-GLUCOPYRANOSYLAMINO)BENZENESULFONAMIDE, N,N',2,3,4,6-HEXAACETATE
Systematic Name English
N4-.BETA.-D-GLUCOSYLSULFANILAMIDE N,N',2,3,4,6-HEXAACETATE [MI]
Common Name English
Code System Code Type Description
CAS
1195249-77-4
Created by admin on Sat Dec 16 08:45:20 GMT 2023 , Edited by admin on Sat Dec 16 08:45:20 GMT 2023
PRIMARY
PUBCHEM
90479239
Created by admin on Sat Dec 16 08:45:20 GMT 2023 , Edited by admin on Sat Dec 16 08:45:20 GMT 2023
PRIMARY
FDA UNII
058XUH0IY1
Created by admin on Sat Dec 16 08:45:20 GMT 2023 , Edited by admin on Sat Dec 16 08:45:20 GMT 2023
PRIMARY
MERCK INDEX
m746
Created by admin on Sat Dec 16 08:45:20 GMT 2023 , Edited by admin on Sat Dec 16 08:45:20 GMT 2023
PRIMARY Merck Index