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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP020200

Dehydroaustin

Formula: C27H30O9  |  Mol. Weight: 498.50 g/mol

IUPAC: [(1R,2S,5S,7S,8S,9R,12S,13S)-2,2',2',9,13-pentamethyl-6,16-dimethylidene-6',11,15-trioxospiro[10,14,17-trioxapentacyclo[7.6.1.17,12.01,12.02,7]heptadecane-5,3'-pyran]-8-yl] acetate

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Overview

Molecular Formula C27H30O9
Molecular Weight 498.50 g/mol
Canonical SMILES CC1C23C(=O)OC4(C(C5(O2)C(=C)C6(CCC5(C3(C4=C)C(=O)O1)C)C=CC(=O)OC6(C)C)OC(=O)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy