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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP003412

[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(1R,4S,5R,6S,7R,8S,9S)-4,5,6-trihydroxy-2,10-dioxatricyclo[5.3.1.04,8]undecan-9-yl]oxy]oxan-2-yl]methyl (E)-3-phenylprop-2-enoate

Formula: C24H30O12  |  Mol. Weight: 510.50 g/mol

IUPAC: [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(1R,4S,5R,6S,7R,8S,9S)-4,5,6-trihydroxy-2,10-dioxatricyclo[5.3.1.04,8]undecan-9-yl]oxy]oxan-2-yl]methyl (E)-3-phenylprop-2-enoate

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Overview

Molecular Formula C24H30O12
Molecular Weight 510.50 g/mol
Canonical SMILES C1C2C3C(OC1OCC3(C(C2O)O)O)OC4C(C(C(C(O4)COC(=O)C=CC5=CC=CC=C5)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy