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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP006180

(2R,3R,4R,5R)-2-[(1R)-1,2-dihydroxyethyl]-5-[[(1R,5R,10R,13R,14S,17R,19S,22R)-7,7,10,13,14,18,18-heptamethyl-19-hexacyclo[12.9.0.01,22.04,13.05,10.017,22]tricos-3-enyl]oxy]oxolane-3,4-diol

Formula: C36H58O6  |  Mol. Weight: 586.80 g/mol

IUPAC: (2R,3R,4R,5R)-2-[(1R)-1,2-dihydroxyethyl]-5-[[(1R,5R,10R,13R,14S,17R,19S,22R)-7,7,10,13,14,18,18-heptamethyl-19-hexacyclo[12.9.0.01,22.04,13.05,10.017,22]tricos-3-enyl]oxy]oxolane-3,4-diol

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Overview

Molecular Formula C36H58O6
Molecular Weight 586.80 g/mol
Canonical SMILES CC1(CCC2(CCC3(C(=CCC45C3(CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(O7)C(CO)O)O)O)C)C2C1)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy