Compound BIMP009456

(1S,2S,4S,7R,9S,12R,13S,16S)-4-(furan-3-yl)-12-hydroxy-2,16-dimethyl-13-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethylsulfanyl]-5,10-dioxatetracyclo[7.6.1.02,7.012,16]hexadecane-6,11-dione

Formula: C₂₈H₃₈O₁₂S | Mol. Weight: 598.70 g/mol

IUPAC: (1S,2S,4S,7R,9S,12R,13S,16S)-4-(furan-3-yl)-12-hydroxy-2,16-dimethyl-13-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethylsulfanyl]-5,10-dioxatetracyclo[7.6.1.02,7.012,16]hexadecane-6,11-dione

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Overview

Molecular Formula C₂₈H₃₈O₁₂S

Molecular Weight 598.70 g/mol

Canonical SMILES CC12CC(OC(=O)C1CC3C4(C2CCC(C4(C(=O)O3)O)SCCOC5C(C(C(C(O5)CO)O)O)O)C)C6=COC=C6

Bioactivity of Indian Medicinal Plants

(1S,2S,4S,7R,9S,12R,13S,16S)-4-(furan-3-yl)-12-hydroxy-2,16-dimethyl-13-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethylsulfanyl]-5,10-dioxatetracyclo[7.6.1.02,7.012,16]hexadecane-6,11-dione

Overview

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

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