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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP036050

Lactupicrin methyl ester

Formula: C25H28O8  |  Mol. Weight: 456.50 g/mol

IUPAC: methyl 2-[4-hydroxy-3-(hydroxymethyl)-6-[2-(4-hydroxyphenyl)acetyl]oxy-6,8-dimethyl-1-oxo-3a,4,5,7-tetrahydroazulen-5-yl]prop-2-enoate

Overview

Molecular Formula C25H28O8
Molecular Weight 456.50 g/mol
Canonical SMILES CC1=C2C(C(C(C(C1)(C)OC(=O)CC3=CC=C(C=C3)O)C(=C)C(=O)OC)O)C(=CC2=O)CO

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy