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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP010696

Quadranoside II

Formula: C36H58O11  |  Mol. Weight: 666.80 g/mol

IUPAC: [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1R,3aS,5aR,5bR,7R,7aR,8R,9R,10R,11aR,11bR,13aR,13bR)-7,9,10-trihydroxy-8-(hydroxymethyl)-5a,5b,8,11a-tetramethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylate

Overview

Molecular Formula C36H58O11
Molecular Weight 666.80 g/mol
Canonical SMILES CC(=C)C1CCC2(C1C3CCC4C5(CC(C(C(C5C(CC4(C3(CC2)C)C)O)(C)CO)O)O)C)C(=O)OC6C(C(C(C(O6)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy