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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP003053

[(1R,6R,7R,10S,15R,16S,17S,18S,19S,20S)-19,20-diacetyloxy-6-(furan-3-yl)-16-(2-methoxy-2-oxoethyl)-7,12,15,17-tetramethyl-4-oxo-5,11,13,21-tetraoxaheptacyclo[10.8.1.114,17.01,10.02,7.010,15.014,19]docos-2-en-18-yl] 2,3-dimethyloxirane-2-carboxylate

Formula: C38H44O15  |  Mol. Weight: 740.70 g/mol

IUPAC: [(1R,6R,7R,10S,15R,16S,17S,18S,19S,20S)-19,20-diacetyloxy-6-(furan-3-yl)-16-(2-methoxy-2-oxoethyl)-7,12,15,17-tetramethyl-4-oxo-5,11,13,21-tetraoxaheptacyclo[10.8.1.114,17.01,10.02,7.010,15.014,19]docos-2-en-18-yl] 2,3-dimethyloxirane-2-carboxylate

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Overview

Molecular Formula C38H44O15
Molecular Weight 740.70 g/mol
Canonical SMILES CC1C(O1)(C)C(=O)OC2C3(CC45C2(C(C67C8=CC(=O)OC(C8(CCC6(C4(C3CC(=O)OC)C)OC(O5)(O7)C)C)C9=COC=C9)OC(=O)C)OC(=O)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy