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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP003884

Laetirobin

Formula: C44H32O12  |  Mol. Weight: 752.70 g/mol

IUPAC: 1-[2-[(9bR)-8-acetyl-1,1-bis(5-acetyl-6-hydroxy-1-benzofuran-2-yl)-7-hydroxy-3,9b-dihydro-2H-dibenzofuran-4-yl]-6-hydroxy-1-benzofuran-5-yl]ethanone

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Overview

Molecular Formula C44H32O12
Molecular Weight 752.70 g/mol
Canonical SMILES CC(=O)C1=C(C=C2C(=C1)C=C(O2)C3=C4C(C5=CC(=C(C=C5O4)O)C(=O)C)C(CC3)(C6=CC7=CC(=C(C=C7O6)O)C(=O)C)C8=CC9=CC(=C(C=C9O8)O)C(=O)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy