Compound Identification
SMILES
COC(=O)[C@@]12N(CCC3=C1NC1=C3C=C(Cl)C=C1)C(=O)[C@H]1[C@@H]([C@H]3O[C@@]21C=C3)C1=CC=CC=C1
InChIKey
InChIKey=ALOQZJUGCDJDDR-XZMORJKJSA-N
Formula
C26H21ClN2O4
Mass
460.91
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
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Subclass
Carbohydrates and carbohydrate conjugates
- Level 5 Sugar acids and derivatives
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Subclass
Carbohydrates and carbohydrate conjugates
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Class
Organooxygen compounds
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Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbohydrates and carbohydrate conjugates
Intermediate Tree Nodes
Sugar acids and derivatives - Sugar amino acids and derivatives
Direct Parent
Bicyclic amino acids and derivatives
Alternative Parents
Beta carbolines Alpha amino acid esters Isoindolones 3-alkylindoles Furopyrroles Pyrrolidine carboxylic acids Oxoprolines Pyrrolidine-2-ones N-alkylpyrrolidines Benzene and substituted derivatives Aryl chlorides Pyrroles Methyl esters Furans Tertiary carboxylic acid amides Heteroaromatic compounds Dihydrofurans Oxolanes Lactams Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Organic oxides Organochlorides Carbonyl compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Bicyclic amino acid - Alpha-amino acid ester - Beta-carboline - Pyridoindole - Alpha-amino acid or derivatives - Isoindolone - 3-alkylindole - Indole - Indole or derivatives - Isoindoline - Isoindole or derivatives - Furopyrrole - Oxoproline - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - 2-pyrrolidone - Aryl chloride - Pyrrolidone - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Pyrrole - Dihydrofuran - Oxolane - Furan - Methyl ester - Pyrrolidine - Lactam - Carboxylic acid ester - Carboxamide group - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Monocarboxylic acid or derivatives - Ether - Organonitrogen compound - Carbonyl group - Organochloride - Hydrocarbon derivative - Organohalogen compound - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as bicyclic amino acids and derivatives. These are sugar amino acids in which the amino acid is attached to or partly borne within a bicyclic ring system.
External Descriptors
Not available