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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP020056

(1R,4R,8R,9R,10S)-4-(2-hydroxypropan-2-yl)-1,9-dimethyl-8-[(2S)-2-methylbutanoyl]-10-(3-methylbut-2-enyl)-9-(4-methylpent-3-enyl)-3-oxatricyclo[6.3.1.02,6]dodec-2(6)-ene-7,12-dione

Formula: C32H48O5  |  Mol. Weight: 512.70 g/mol

IUPAC: (1R,4R,8R,9R,10S)-4-(2-hydroxypropan-2-yl)-1,9-dimethyl-8-[(2S)-2-methylbutanoyl]-10-(3-methylbut-2-enyl)-9-(4-methylpent-3-enyl)-3-oxatricyclo[6.3.1.02,6]dodec-2(6)-ene-7,12-dione

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Overview

Molecular Formula C32H48O5
Molecular Weight 512.70 g/mol
Canonical SMILES CCC(C)C(=O)C12C(=O)C3=C(C(C1=O)(CC(C2(C)CCC=C(C)C)CC=C(C)C)C)OC(C3)C(C)(C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy