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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP038500

[(3R,4S,5S,6R)-2-[[(3S,4aR,6aS,6bR,8aR,14aS,14bR)-4,4,4a,6a,6b,8a,11,11,14a,14b-decamethyl-1,2,3,5,6,6a,7,8,9,10,12,12a,13,14-tetradecahydropicen-3-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] acetate

Formula: C40H68O7  |  Mol. Weight: 661.00 g/mol

IUPAC: [(3R,4S,5S,6R)-2-[[(3S,4aR,6aS,6bR,8aR,14aS,14bR)-4,4,4a,6a,6b,8a,11,11,14a,14b-decamethyl-1,2,3,5,6,6a,7,8,9,10,12,12a,13,14-tetradecahydropicen-3-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] acetate

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Overview

Molecular Formula C40H68O7
Molecular Weight 661.00 g/mol
Canonical SMILES CC(=O)OC1C(C(C(OC1OC2CCC3(C4(CCC5C6CC(CCC6(CCC5(C4(CCC3(C2(C)C)C)C)C)C)(C)C)C)C)CO)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy