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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP019589

Agallochin O

Formula: C21H32O3  |  Mol. Weight: 332.50 g/mol

IUPAC: methyl 3-[(1S,4R,5R,6S,9R)-10-(hydroxymethyl)-5-methyl-4-prop-1-en-2-yl-5-tricyclo[7.2.1.01,6]dodec-10-enyl]propanoate

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Overview

Molecular Formula C21H32O3
Molecular Weight 332.50 g/mol
Canonical SMILES CC(=C)C1CCC23CC(CCC2C1(C)CCC(=O)OC)C(=C3)CO

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy