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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP014238

Lycernuic ketone B

Formula: C31H48O6  |  Mol. Weight: 516.70 g/mol

IUPAC: methyl (3S,6R,7R,8R,11R,12S,15S,16R,19R,20S,21R)-8,19-dihydroxy-20-(hydroxymethyl)-3,7,11,16,20-pentamethyl-22-oxopentacyclo[13.8.0.03,12.06,11.016,21]tricos-1(23)-ene-7-carboxylate

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Overview

Molecular Formula C31H48O6
Molecular Weight 516.70 g/mol
Canonical SMILES CC12CCC3C(C1CCC4C(=CC(=O)C5C4(CCC(C5(C)CO)O)C)C2)(CCC(C3(C)C(=O)OC)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy