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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP038662

11-[3-[2,3-Dihydroxy-4-[5-hydroxy-6-methyl-3,4-bis[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy-5-methyloxan-2-yl]oxy-4,5-dihydroxy-6-methyloxan-2-yl]oxytetradecanoic acid

Formula: C44H78O23  |  Mol. Weight: 975.10 g/mol

IUPAC: 11-[3-[2,3-dihydroxy-4-[5-hydroxy-6-methyl-3,4-bis[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy-5-methyloxan-2-yl]oxy-4,5-dihydroxy-6-methyloxan-2-yl]oxytetradecanoic acid

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Overview

Molecular Formula C44H78O23
Molecular Weight 975.10 g/mol
Canonical SMILES CCCC(CCCCCCCCCC(=O)O)OC1C(C(C(C(O1)C)O)O)OC2(C(C(C(CO2)C)OC3C(C(C(C(O3)C)O)OC4C(C(C(C(O4)C)O)O)O)OC5C(C(C(C(O5)C)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy