Compound Identification
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.CC(C)(CN)OCCOC(=O)C1C2=CC=CC=C2CCC2=CC=CC=C12
InChIKey
InChIKey=OTPNPLYBVMHNPP-UHFFFAOYSA-N
Formula
C28H35NO10
Mass
545.585
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Dibenzocycloheptenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Dibenzocycloheptenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Dibenzocycloheptenes
Alternative Parents
Tricarboxylic acids and derivatives Alpha hydroxy acids and derivatives Tertiary alcohols Carboxylic acid esters Amino acids and derivatives Dialkyl ethers Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Dibenzocycloheptene - Tricarboxylic acid or derivatives - Alpha-hydroxy acid - Hydroxy acid - Tertiary alcohol - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Organopnictogen compound - Alcohol - Primary aliphatic amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Amine - Organic oxide - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as dibenzocycloheptenes. These are compounds containing a dibenzocycloheptene moiety, which consists of two benzene rings connected by a cycloheptene ring.
External Descriptors
Not available