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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP025619

(1R,2S,3S,5S,8S,11R,12R)-5-(furan-3-yl)-8-hydroxy-3,11-dimethyl-12-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6,14-dioxatetracyclo[10.2.2.02,11.03,8]hexadec-15-ene-7,13-dione

Formula: C26H32O12  |  Mol. Weight: 536.50 g/mol

IUPAC: (1R,2S,3S,5S,8S,11R,12R)-5-(furan-3-yl)-8-hydroxy-3,11-dimethyl-12-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6,14-dioxatetracyclo[10.2.2.02,11.03,8]hexadec-15-ene-7,13-dione

Overview

Molecular Formula C26H32O12
Molecular Weight 536.50 g/mol
Canonical SMILES CC12CCC3(C(=O)OC(CC3(C1C4C=CC2(C(=O)O4)OC5C(C(C(C(O5)CO)O)O)O)C)C6=COC=C6)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy