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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP034716

[(1R,2R,3R,4S,7R,8R,15R,17S,19S)-8-(furan-3-yl)-2-[(1R)-1-hydroxy-2-methoxy-2-oxoethyl]-1,3,7-trimethyl-19-[(E)-2-methylbut-2-enoyl]oxy-10-oxo-9,16-dioxapentacyclo[13.3.1.03,17.04,13.07,12]nonadeca-11,13-dien-15-yl] pentanoate

Formula: C37H46O11  |  Mol. Weight: 666.80 g/mol

IUPAC: [(1R,2R,3R,4S,7R,8R,15R,17S,19S)-8-(furan-3-yl)-2-[(1R)-1-hydroxy-2-methoxy-2-oxoethyl]-1,3,7-trimethyl-19-[(E)-2-methylbut-2-enoyl]oxy-10-oxo-9,16-dioxapentacyclo[13.3.1.03,17.04,13.07,12]nonadeca-11,13-dien-15-yl] pentanoate

Overview

Molecular Formula C37H46O11
Molecular Weight 666.80 g/mol
Canonical SMILES CCCCC(=O)OC12C=C3C(CCC4(C3=CC(=O)OC4C5=COC=C5)C)C6(C(O1)CC(C6C(C(=O)OC)O)(C2OC(=O)C(=CC)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy