Compound Identification
SMILES
CCC[C@]1(O)O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)C1=C(C=CC=C1OC)C2=O
InChIKey
InChIKey=GVKVQBCPWHXCPU-VMKIBOBSSA-N
Formula
C19H18O7
Mass
358.346
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
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 Quinones Anisoles Aryl ketones Pyranones and derivatives Alkyl aryl ethers Gamma butyrolactones Oxolanes Furans Hemiacetals Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoisochromanequinone - Naphthopyranone - Naphthopyran - Naphthoquinone - Naphthalene - Furopyran - Anisole - Aryl ketone - Phenol ether - Quinone - Alkyl aryl ether - Pyranone - Benzenoid - Pyran - Gamma butyrolactone - Oxolane - Furan - Carboxylic acid ester - Lactone - Ketone - Hemiacetal - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - 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