Compound Synopsis
Compound Overview
Bioactivity Data Summary
Protein Affinity Profile
Cellline Sensitivity Profile

754101 - Overview - Compound Synopsis

Synonyms
SCRSUCROSOFATE
Sucrosofate
Molecular Formula
C12H22O35S8
InChI
InChI=1S/C12H22O35S8/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)/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1
Smiles
O=S(=O)(O)OC[C@H]1O[C@H](O[C@]2(COS(=O)(=O)O)O[C@H](COS(=O)(=O)O)[C@@H](OS(=O)(=O)O)[C@@H]2OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@@H](OS(=O)(=O)O)[C@@H]1OS(=O)(=O)O
Cross References
UniChem638214
canSAR754101
PDBe (Protein Data Bank Europe)SCR
ChEMBLCHEMBL1235872
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 981.770730404-6.778883577No


Compounds with the same scaffold


Image of compound ID: 754101
Murko Scaffold Family: 133 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12





Compound Lineages


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