Compound Identification
SMILES
CC1(C)C2(C)CCC1(OC2=O)C(=O)O[C@H]1[C@@H](OC(=O)C23CCC(C)(C(=O)O2)C3(C)C)C(C)(C)OC2=C1C1=C(C=CC(=O)O1)C=C2
InChIKey
InChIKey=ZJIDTNTWJHYPGM-MRAUNTDJSA-N
Formula
C34H38O11
Mass
622.667
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Coumarins and derivatives
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Subclass
Pyranocoumarins
- Level 5 Angular pyranocoumarins
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Subclass
Pyranocoumarins
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Class
Coumarins and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Pyranocoumarins
Intermediate Tree Nodes
Not available
Direct Parent
Angular pyranocoumarins
Alternative Parents
Pyranochromenes Tetracarboxylic acids and derivatives 2,2-dimethyl-1-benzopyrans Pyranones and derivatives Alkyl aryl ethers Delta valerolactones Oxanes Benzenoids Gamma butyrolactones Tetrahydrofurans Heteroaromatic compounds Carboxylic acid esters Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Angular pyranocoumarin - Pyranochromene - Tetracarboxylic acid or derivatives - 2,2-dimethyl-1-benzopyran - Chromane - Benzopyran - 1-benzopyran - Alkyl aryl ether - Delta valerolactone - Delta_valerolactone - Pyranone - Benzenoid - Gamma butyrolactone - Oxane - Pyran - Heteroaromatic compound - Tetrahydrofuran - Lactone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as angular pyranocoumarins. These are organic compounds containing a pyran (or a hydrogenated derivative) angularly fused to a coumarin moiety.
External Descriptors
Not available