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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H24O10S2
Molecular Weight 452.496
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .BETA..-D-GLUCOPYRANOSE, 1-THIO-, 2,3,4,6-TETRAACETATE 1-(O-ETHYL CARBONODITHIOATE)

SMILES

CCOC(=S)S[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

InChI

InChIKey=GYORARISFGRNMU-LJIZCISZSA-N
InChI=1S/C17H24O10S2/c1-6-22-17(28)29-16-15(26-11(5)21)14(25-10(4)20)13(24-9(3)19)12(27-16)7-23-8(2)18/h12-16H,6-7H2,1-5H3/t12-,13-,14+,15-,16+/m1/s1

HIDE SMILES / InChI

Molecular Formula C17H24O10S2
Molecular Weight 452.496
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 13:17:25 GMT 2023
Edited
by admin
on Sat Dec 16 13:17:25 GMT 2023
Record UNII
6B7H7VSR0Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.BETA..-D-GLUCOPYRANOSE, 1-THIO-, 2,3,4,6-TETRAACETATE 1-(O-ETHYL CARBONODITHIOATE)
Systematic Name English
GLUCOPYRANOSE, 1-THIO-, 2,3,4,6-TETRAACETATE 1-(O-ETHYL DITHIOCARBONATE), .BETA.-D-
Systematic Name English
NSC-66060
Code English
Code System Code Type Description
FDA UNII
6B7H7VSR0Q
Created by admin on Sat Dec 16 13:17:25 GMT 2023 , Edited by admin on Sat Dec 16 13:17:25 GMT 2023
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NSC
66060
Created by admin on Sat Dec 16 13:17:25 GMT 2023 , Edited by admin on Sat Dec 16 13:17:25 GMT 2023
PRIMARY
CAS
13639-54-8
Created by admin on Sat Dec 16 13:17:25 GMT 2023 , Edited by admin on Sat Dec 16 13:17:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID60159780
Created by admin on Sat Dec 16 13:17:25 GMT 2023 , Edited by admin on Sat Dec 16 13:17:25 GMT 2023
PRIMARY
PUBCHEM
5481351
Created by admin on Sat Dec 16 13:17:25 GMT 2023 , Edited by admin on Sat Dec 16 13:17:25 GMT 2023
PRIMARY