Structure Information
Structure

Compound Identification

SMILES

CSCCC(N=C(O)C(CC1=CNC2=CC=CC=C12)N=C(O)CN=C(O)C(N=C(O)C(CC1=CC=C(OS(O)(=O)=O)C=C1)N=C(O)C(CC(O)=O)N=C(O)C(N)CCCNC(N)=N)C(C)C)C(O)=NC(CC(O)=O)C(O)=NC(CC1=CC=CC=C1)C(O)=N

InChIKey

InChIKey=XABUVDVSEMIDIN-UHFFFAOYSA-N

Formula

C55H74N14O17S2

Mass

1267.4

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Organic sulfuric acids and derivatives

Subclass

Arylsulfates

Intermediate Tree Nodes

Not available

Direct Parent

Phenylsulfates

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenylsulfate - Amphetamine or derivatives - Indole or derivatives - Indole - Phenoxy compound - Benzenoid - Sulfuric acid ester - Sulfate-ester - Sulfuric acid monoester - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Heteroaromatic compound - Pyrroline - Pyrrole - Amino acid - Guanidine - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Dialkylthioether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Carboximidamide - Thioether - Secondary amine - Secondary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Carboximidic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Imine - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylsulfates. These are compounds containing a sulfuric acid group conjugated to a phenyl group.

External Descriptors

Not available

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