Compound Identification
SMILES
[Cl-].C[C@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)C1=C(O)C=C3C([C@H]4C[C@H]([C@H](O)[C@]3(C)O4)[NH+](C)C)=C1C2=O
InChIKey
InChIKey=PJQXHFQQRQLCDQ-GGFLUZQKSA-N
Formula
C24H26ClNO8
Mass
491.92
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Isochromanequinones
- Subclass Benzoisochromanequinones
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Class
Isochromanequinones
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Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isochromanequinones
Subclass
Benzoisochromanequinones
Intermediate Tree Nodes
Not available
Direct Parent
Benzoisochromanequinones
Alternative Parents
Naphthopyranones Naphthoquinones Furopyrans Isocoumarans Aryl ketones Quinones 1-hydroxy-2-unsubstituted benzenoids Aralkylamines Pyranones and derivatives Gamma butyrolactones Oxanes Vinylogous acids Oxolanes Quaternary ammonium salts Furans 1,2-aminoalcohols Carboxylic acid esters Secondary alcohols Trialkylamines Amino acids and derivatives Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Organic chloride salts Hydrocarbon derivatives Organic oxides Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoisochromanequinone - Naphthopyranone - Naphthopyran - Naphthoquinone - Naphthalene - Furopyran - Isocoumaran - Quinone - Aryl ketone - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Pyranone - Aralkylamine - Oxane - Pyran - Benzenoid - Gamma butyrolactone - Furan - Vinylogous acid - Oxolane - Quaternary ammonium salt - Secondary alcohol - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxylic acid ester - Lactone - Ketone - 1,2-aminoalcohol - Carboxylic acid derivative - Organoheterocyclic compound - Dialkyl ether - Oxacycle - Ether - Monocarboxylic acid or derivatives - Organic zwitterion - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic chloride salt - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Alcohol - Amine - Organic salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoisochromanequinones. These are benzo derivatives of isochromanequinones. Isochromanequinones are structurally characterized by a quinone fused to an isochromane, and forming a naphtho[2,3-c]pyran-6,9-dione skeleton.
External Descriptors
Not available