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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP024252

Sambacin

Formula: C26H36O12  |  Mol. Weight: 540.60 g/mol

IUPAC: (1R,8E,9Z,14S,15S,17R)-8-ethylidene-15-[(2R)-1-hydroxypropan-2-yl]-17-methyl-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,6,12-trioxatricyclo[12.2.1.04,9]heptadeca-4,9-diene-3,11-dione

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Overview

Molecular Formula C26H36O12
Molecular Weight 540.60 g/mol
Canonical SMILES CC=C1C(OC=C2C1=CC(=O)OCC3C(C(CC3C(C)CO)OC2=O)C)OC4C(C(C(C(O4)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy