Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(CCCOCC2=CC=CC=C2)N=C(N(CC2=CC=C(OC)C=C2)C(=O)OC(C)(C)C)N2[C@@H](CO)CC[C@H]12

InChIKey

InChIKey=XXPAFKSHZPKACG-LEAFIULHSA-N

Formula

C33H43N3O7

Mass

593.721

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolopyrimidines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Pyrrolopyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzylether - Pyrrolopyrimidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - 1,6-dihydropyrimidine - Benzenoid - Hydropyrimidine - Enoate ester - Methyl ester - Pyrrolidine - Alpha,beta-unsaturated carboxylic ester - Carbamic acid ester - Carboxylic acid ester - Guanidine - Carboxylic acid derivative - Azacycle - Dialkyl ether - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Alcohol - Organonitrogen compound - Organooxygen compound - Primary alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrrolopyrimidines. These are compounds containing a pyrrolopyrimidine moiety, which consists of a pyrrole ring fused to a pyrimidine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.

External Descriptors

Not available

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