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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP033158

methyl 3-[(1R,2R,5S,6R,8R,10R,11S,12R,15S)-10-hydroxy-5-[(2R)-2-hydroxy-6-methyl-4-oxohept-5-en-2-yl]-1,2,11-trimethyl-9-oxatetracyclo[6.6.1.02,6.011,15]pentadecan-12-yl]-3-methyl-2-oxobutanoate

Formula: C31H48O7  |  Mol. Weight: 532.70 g/mol

IUPAC: methyl 3-[(1R,2R,5S,6R,8R,10R,11S,12R,15S)-10-hydroxy-5-[(2R)-2-hydroxy-6-methyl-4-oxohept-5-en-2-yl]-1,2,11-trimethyl-9-oxatetracyclo[6.6.1.02,6.011,15]pentadecan-12-yl]-3-methyl-2-oxobutanoate

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Overview

Molecular Formula C31H48O7
Molecular Weight 532.70 g/mol
Canonical SMILES CC(=CC(=O)CC(C)(C1CCC2(C1CC3C4C2(CCC(C4(C(O3)O)C)C(C)(C)C(=O)C(=O)OC)C)C)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy