Compound Identification
SMILES
OS(=O)(=O)C1=C(\C=C\C2=C(C=C(C=C2)N=C=S)S(O)(=O)=O)C=CC(=C1)N=C=S
InChIKey
InChIKey=YSCNMFDFYJUPEF-OWOJBTEDSA-N
Formula
C16H10N2O6S4
Mass
454.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Stilbenes
- Subclass Sulfonated stilbenes
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Class
Stilbenes
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Stilbenes
Subclass
Sulfonated stilbenes
Intermediate Tree Nodes
Not available
Direct Parent
Sulfonated stilbenes
Alternative Parents
Benzenesulfonic acids and derivatives Benzenesulfonyl compounds 1-sulfo,2-unsubstituted aromatic compounds Styrenes Sulfonyls Organosulfonic acids Isothiocyanates Propargyl-type 1,3-dipolar organic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Sulfonated stilbene - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Styrene - Monocyclic benzene moiety - Benzenoid - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Isothiocyanate - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as sulfonated stilbenes. These are stilbenes that carry a sulfone group at one or more positions of either benzene rings.
External Descriptors
CHEBI:4286 :
4,4'-diisothiocyanostilbene-2,2'-disulfonic acid
LIPIDMAPS (LMPK13090003) :
Diphenyl ethers, biphenyls, dibenzyls and stilbenes
KEGG (C11591) :
Diphenyl ethers, biphenyls, dibenzyls and stilbenes