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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP026003

[(1S,2R,3R,4S,5S,7R,8S,9R,10R,11S)-2,7,8-triacetyloxy-11-(2-acetyloxypropan-2-yl)-5,9-dimethyl-14-oxo-16-oxatetracyclo[7.5.2.01,10.03,7]hexadec-12-en-4-yl] propanoate

Formula: C31H42O12  |  Mol. Weight: 606.70 g/mol

IUPAC: [(1S,2R,3R,4S,5S,7R,8S,9R,10R,11S)-2,7,8-triacetyloxy-11-(2-acetyloxypropan-2-yl)-5,9-dimethyl-14-oxo-16-oxatetracyclo[7.5.2.01,10.03,7]hexadec-12-en-4-yl] propanoate

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Overview

Molecular Formula C31H42O12
Molecular Weight 606.70 g/mol
Canonical SMILES CCC(=O)OC1C(CC2(C1C(C34COC(C3C(C=CC4=O)C(C)(C)OC(=O)C)(C2OC(=O)C)C)OC(=O)C)OC(=O)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy