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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP037144

Eschscholtzxanthone

Formula: C40H52O2  |  Mol. Weight: 564.80 g/mol

IUPAC: (4Z)-4-[(2E,4E,6E,8E,10E,12E,14E,16E,18Z)-18-[(4S)-4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-ylidene]-3,7,12,16-tetramethyloctadeca-2,4,6,8,10,12,14,16-octaenylidene]-3,5,5-trimethylcyclohex-2-en-1-one

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Overview

Molecular Formula C40H52O2
Molecular Weight 564.80 g/mol
Canonical SMILES CC1=CC(CC(C1=CC=C(C)C=CC=C(C)C=CC=CC(=CC=CC(=CC=C2C(=CC(=O)CC2(C)C)C)C)C)(C)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy