Compound Identification
SMILES
NCCS(O)(=O)=O.NC(CO)C(O)=O.OC(=O)C(CC1=CC=C(O)C=C1)NI
InChIKey
InChIKey=MQHGGGJKWINNGP-UHFFFAOYSA-N
Formula
C14H24IN3O9S
Mass
537.32
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Tyrosine and derivatives
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Level 6
Alpha amino acids and derivatives
-
Level 5
Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Tyrosine and derivatives
Alternative Parents
Phenylalanine and derivatives Serine and derivatives Phenylpropanoic acids Alpha amino acids Amphetamines and derivatives Beta hydroxy acids and derivatives 1-hydroxy-2-unsubstituted benzenoids Organosulfonic acids Alkanesulfonic acids Sulfonyls Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds Primary alcohols
Molecular Framework
Not available
Substituents
Tyrosine or derivatives - Phenylalanine or derivatives - Serine or derivatives - 3-phenylpropanoic-acid - Alpha-amino acid - Amphetamine or derivatives - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Beta-hydroxy acid - Monocyclic benzene moiety - Hydroxy acid - Benzenoid - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Alkanesulfonic acid - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Alcohol - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Primary aliphatic amine - Primary alcohol - Primary amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as tyrosine and derivatives. These are compounds containing tyrosine or a derivative thereof resulting from reaction of tyrosine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available