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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H14O35S8.8K
Molecular Weight 1287.525
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SUCROSOFATE POTASSIUM ANHYDROUS

SMILES

[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[O-]S(=O)(=O)OC[C@H]1O[C@@](COS([O-])(=O)=O)(O[C@H]2O[C@H](COS([O-])(=O)=O)[C@@H](OS([O-])(=O)=O)[C@H](OS([O-])(=O)=O)[C@H]2OS([O-])(=O)=O)[C@@H](OS([O-])(=O)=O)[C@@H]1OS([O-])(=O)=O

InChI

InChIKey=XISWAUUBQBEDFB-QRDGSJRXSA-F
InChI=1S/C12H22O35S8.8K/c13-48(14,15)37-1-4-6(43-51(22,23)24)8(45-53(28,29)30)9(46-54(31,32)33)11(40-4)42-12(3-39-50(19,20)21)10(47-55(34,35)36)7(44-52(25,26)27)5(41-12)2-38-49(16,17)18;;;;;;;;/h4-11H,1-3H2,(H,13,14,15)(H,16,17,18)(H,19,20,21)(H,22,23,24)(H,25,26,27)(H,28,29,30)(H,31,32,33)(H,34,35,36);;;;;;;;/q;8*+1/p-8/t4-,5-,6-,7-,8+,9-,10+,11-,12+;;;;;;;;/m1......../s1

HIDE SMILES / InChI

Molecular Formula C12H14O35S8
Molecular Weight 974.739
Charge -8
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula K
Molecular Weight 39.0983
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:50:31 UTC 2023
Edited
by admin
on Sat Dec 16 05:50:31 UTC 2023
Record UNII
A8CB6ERJ54
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SUCROSOFATE POTASSIUM ANHYDROUS
Common Name English
POTASSIUM SUCROSE OCTASULFATE
Common Name English
.ALPHA.-D-GLUCOPYRANOSIDE, 1,3,4,6-TETRA-O-SULFO-.BETA.-D-FRUCTOFURANOSYL, 2,3,4,6-TETRAKIS(HYDROGEN SULFATE), POTASSIUM SALT (1:8)
Common Name English
POTASSIUM SUCROSE OCTASULFATE [USP-RS]
Common Name English
Code System Code Type Description
PUBCHEM
71947
Created by admin on Sat Dec 16 05:50:31 UTC 2023 , Edited by admin on Sat Dec 16 05:50:31 UTC 2023
PRIMARY
FDA UNII
A8CB6ERJ54
Created by admin on Sat Dec 16 05:50:31 UTC 2023 , Edited by admin on Sat Dec 16 05:50:31 UTC 2023
PRIMARY
RS_ITEM_NUM
1551150
Created by admin on Sat Dec 16 05:50:31 UTC 2023 , Edited by admin on Sat Dec 16 05:50:31 UTC 2023
PRIMARY
CAS
73264-44-5
Created by admin on Sat Dec 16 05:50:31 UTC 2023 , Edited by admin on Sat Dec 16 05:50:31 UTC 2023
PRIMARY
CAS
111757-57-4
Created by admin on Sat Dec 16 05:50:31 UTC 2023 , Edited by admin on Sat Dec 16 05:50:31 UTC 2023
NON-SPECIFIC STOICHIOMETRY
Related Record Type Details
PARENT -> SALT/SOLVATE
SOLVATE->ANHYDROUS
Related Record Type Details
ACTIVE MOIETY