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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP009299

[(2R,3S,4R,5R,6S)-4,5-dihydroxy-6-[(E)-3-phenylprop-2-enoyl]oxy-2-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] (E)-3-phenylprop-2-enoate

Formula: C30H34O13  |  Mol. Weight: 602.60 g/mol

IUPAC: [(2R,3S,4R,5R,6S)-4,5-dihydroxy-6-[(E)-3-phenylprop-2-enoyl]oxy-2-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl] (E)-3-phenylprop-2-enoate

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Overview

Molecular Formula C30H34O13
Molecular Weight 602.60 g/mol
Canonical SMILES C1=CC=C(C=C1)C=CC(=O)OC2C(OC(C(C2O)O)OC(=O)C=CC3=CC=CC=C3)COC4C(C(C(C(O4)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy