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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP031331

(1R,4S,8R,9R,10S)-4-(2-hydroxypropan-2-yl)-9-methyl-1,10-bis(3-methylbut-2-enyl)-9-(4-methyl-3-oxopentyl)-8-(2-methylpropanoyl)-3-oxatricyclo[6.3.1.02,6]dodec-2(6)-ene-7,12-dione

Formula: C35H52O6  |  Mol. Weight: 568.80 g/mol

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

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Overview

Molecular Formula C35H52O6
Molecular Weight 568.80 g/mol
Canonical SMILES CC(C)C(=O)CCC1(C(CC2(C3=C(CC(O3)C(C)(C)O)C(=O)C1(C2=O)C(=O)C(C)C)CC=C(C)C)CC=C(C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy