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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP016074

Macrocalin A

Formula: C20H26O5  |  Mol. Weight: 346.40 g/mol

IUPAC: (1S,4S,8R,9R,12S,13S,16R)-9-hydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione

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Overview

Molecular Formula C20H26O5
Molecular Weight 346.40 g/mol
Canonical SMILES CC1(CCC2C3(C1C(OC3)O)C4CCC5CC4(C(=O)C5=C)C(=O)O2)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy