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)N(C)C)=C1C2=O
InChIKey
InChIKey=PJQXHFQQRQLCDQ-BYSQESQXSA-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 Isocoumarans Furopyrans Quinones Aryl ketones Pyranones and derivatives Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Oxanes Gamma butyrolactones Vinylogous acids Tetrahydrofurans Furans Trialkylamines Secondary alcohols Carboxylic acid esters Amino acids and derivatives 1,2-aminoalcohols Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Organopnictogen compounds Organic oxides Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoisochromanequinone - Naphthopyranone - Naphthopyran - Naphthoquinone - Naphthalene - Isocoumaran - Furopyran - Aryl ketone - Quinone - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Pyranone - Benzenoid - Pyran - Oxane - Gamma butyrolactone - Vinylogous acid - Tetrahydrofuran - Furan - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Lactone - Ketone - Carboxylic acid ester - Amino acid or derivatives - 1,2-aminoalcohol - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Hydrochloride - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Alcohol - 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