Compound Identification
SMILES
C[C@H]1OC(CC([C@@H]1O)N(C)C)C1=CC(=O)C2=C(C(O)=C3[C@@H](C)O[C@@H]4CC(=O)O[C@@H]4C3=C2O)C1=O
InChIKey
InChIKey=YKHPVCQWMSOJBO-AJHFTWGYSA-N
Formula
C24H27NO9
Mass
473.478
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Isochromanequinones
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isochromanequinones
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isochromanequinones
Alternative Parents
Naphthopyranones Naphthoquinones 2-benzopyrans Aryl ketones Quinones Pyranones and derivatives Phenols Oxanes Gamma butyrolactones Oxolanes Vinylogous acids 1,2-aminoalcohols Secondary alcohols Carboxylic acid esters Trialkylamines Amino acids and derivatives Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isochromanequinone - Naphthopyranone - Naphthopyran - Naphthoquinone - Naphthalene - Benzopyran - Isochromane - 2-benzopyran - Aryl ketone - Quinone - Phenol - Pyranone - Gamma butyrolactone - Benzenoid - Oxane - Pyran - Vinylogous acid - Oxolane - Tertiary amine - Tertiary aliphatic amine - Ketone - Lactone - Carboxylic acid ester - Amino acid or derivatives - 1,2-aminoalcohol - Secondary alcohol - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Alcohol - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isochromanequinones. These are polycyclic compounds containing an isochromanequinone, which is 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