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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP033747

(1R,2S,4R,12S,14S)-4-(2,4-dihydroxyphenyl)-8-[(E)-2-(2,4-dihydroxyphenyl)ethenyl]-10,18-dihydroxy-14-methyl-3,5,15-trioxahexacyclo[12.6.1.116,20.02,4.02,12.06,11]docosa-6,8,10,16(22),17,19-hexaen-13-one

Formula: C34H26O10  |  Mol. Weight: 594.60 g/mol

IUPAC: (1R,2S,4R,12S,14S)-4-(2,4-dihydroxyphenyl)-8-[(E)-2-(2,4-dihydroxyphenyl)ethenyl]-10,18-dihydroxy-14-methyl-3,5,15-trioxahexacyclo[12.6.1.116,20.02,4.02,12.06,11]docosa-6,8,10,16(22),17,19-hexaen-13-one

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Overview

Molecular Formula C34H26O10
Molecular Weight 594.60 g/mol
Canonical SMILES CC12CC(C3=CC(=CC(=C3)O1)O)C45C(C2=O)C6=C(C=C(C=C6OC4(O5)C7=C(C=C(C=C7)O)O)C=CC8=C(C=C(C=C8)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy