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Details

Stereochemistry ACHIRAL
Molecular Formula C17H16O10S2
Molecular Weight 444.433
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 5-((1E)-2-(((1E)-2-(3,4,5-TRIHYDROXYPHENYL)ETHENESULFONYL)METHANESULFONYL)ETHENYL)BENZENE-1,2,3-TRIOL

SMILES

OC1=CC(\C=C\S(=O)(=O)CS(=O)(=O)\C=C\C2=CC(O)=C(O)C(O)=C2)=CC(O)=C1O

InChI

InChIKey=XNXJTMYPDIHLNJ-ZPUQHVIOSA-N
InChI=1S/C17H16O10S2/c18-12-5-10(6-13(19)16(12)22)1-3-28(24,25)9-29(26,27)4-2-11-7-14(20)17(23)15(21)8-11/h1-8,18-23H,9H2/b3-1+,4-2+

HIDE SMILES / InChI

Molecular Formula C17H16O10S2
Molecular Weight 444.433
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 07:53:11 GMT 2023
Edited
by admin
on Sat Dec 16 07:53:11 GMT 2023
Record UNII
94Z6BJ6J34
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-((1E)-2-(((1E)-2-(3,4,5-TRIHYDROXYPHENYL)ETHENESULFONYL)METHANESULFONYL)ETHENYL)BENZENE-1,2,3-TRIOL
Systematic Name English
1,2,3-BENZENETRIOL, 5,5'-(METHYLENEBIS(SULFONYL-(1E)-2,1-ETHENEDIYL))BIS-
Systematic Name English
DCM-205
Code English
5,5'-(METHYLENEBIS(SULFONYL-(1E)-2,1-ETHENEDIYL))BIS(1,2,3-BENZENETRIOL)
Systematic Name English
DCM205
Code English
Code System Code Type Description
FDA UNII
94Z6BJ6J34
Created by admin on Sat Dec 16 07:53:11 GMT 2023 , Edited by admin on Sat Dec 16 07:53:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID10422512
Created by admin on Sat Dec 16 07:53:11 GMT 2023 , Edited by admin on Sat Dec 16 07:53:11 GMT 2023
PRIMARY
CAS
862097-17-4
Created by admin on Sat Dec 16 07:53:11 GMT 2023 , Edited by admin on Sat Dec 16 07:53:11 GMT 2023
PRIMARY
PUBCHEM
6321066
Created by admin on Sat Dec 16 07:53:11 GMT 2023 , Edited by admin on Sat Dec 16 07:53:11 GMT 2023
PRIMARY