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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP035340

ethyl (1S)-7,8,9-trihydroxy-4-(4-methoxy-4-oxobutyl)-3,5-dioxo-1,2-dihydrocyclopenta[c]isoquinoline-1-carboxylate

Formula: C20H21NO9  |  Mol. Weight: 419.40 g/mol

IUPAC: ethyl (1S)-7,8,9-trihydroxy-4-(4-methoxy-4-oxobutyl)-3,5-dioxo-1,2-dihydrocyclopenta[c]isoquinoline-1-carboxylate

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Overview

Molecular Formula C20H21NO9
Molecular Weight 419.40 g/mol
Canonical SMILES CCOC(=O)C1CC(=O)C2=C1C3=C(C(=C(C=C3C(=O)N2CCCC(=O)OC)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy