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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP018518

[(1S,2S,6R,10S,11R,13S,14R,15R)-14-acetyloxy-1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5,9-dioxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,7-dienyl] 2-methylbutanoate

Formula: C27H36O9  |  Mol. Weight: 504.60 g/mol

IUPAC: [(1S,2S,6R,10S,11R,13S,14R,15R)-14-acetyloxy-1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5,9-dioxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,7-dienyl] 2-methylbutanoate

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Overview

Molecular Formula C27H36O9
Molecular Weight 504.60 g/mol
Canonical SMILES CCC(C)C(=O)OC12C(C1(C)C)C3C(=O)C(=CC4(C(C3(C(C2OC(=O)C)C)O)C=C(C4=O)C)O)CO

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy