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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP006320

(5R,7S,8R,10S)-7-[2-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxypropan-2-yl]-5-hydroxy-10-methyl-2-oxatricyclo[6.3.1.04,12]dodeca-1(12),3-dien-11-one

Formula: C26H38O13  |  Mol. Weight: 558.60 g/mol

IUPAC: (5R,7S,8R,10S)-7-[2-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxypropan-2-yl]-5-hydroxy-10-methyl-2-oxatricyclo[6.3.1.04,12]dodeca-1(12),3-dien-11-one

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Overview

Molecular Formula C26H38O13
Molecular Weight 558.60 g/mol
Canonical SMILES CC1CC2C(CC(C3=COC(=C23)C1=O)O)C(C)(C)OC4C(C(C(C(O4)COC5C(C(CO5)(CO)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy