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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP079020

15-Demethyl plumieride

Formula: C20H24O12  |  Mol. Weight: 456.40 g/mol

IUPAC: methyl (1S,4aS,7R,7aS)-4'-(hydroxymethyl)-5'-oxo-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyspiro[4a,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-furan]-4-carboxylate

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Overview

Molecular Formula C20H24O12
Molecular Weight 456.40 g/mol
Canonical SMILES COC(=O)C1=COC(C2C1C=CC23C=C(C(=O)O3)CO)OC4C(C(C(C(O4)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy

Disease Associations