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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP033864

(2S,3R,4S,5S)-2-(3,5-dihydroxyphenyl)-9-hydroxy-3,5-bis(4-hydroxyphenyl)-11-[(2R,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-6-oxatricyclo[6.3.1.04,12]dodeca-1(11),8(12),9-trien-7-one

Formula: C34H30O12  |  Mol. Weight: 630.60 g/mol

IUPAC: (2S,3R,4S,5S)-2-(3,5-dihydroxyphenyl)-9-hydroxy-3,5-bis(4-hydroxyphenyl)-11-[(2R,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-6-oxatricyclo[6.3.1.04,12]dodeca-1(11),8(12),9-trien-7-one

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Overview

Molecular Formula C34H30O12
Molecular Weight 630.60 g/mol
Canonical SMILES C1C(C(C(C(O1)OC2=C3C(C(C4C3=C(C(=C2)O)C(=O)OC4C5=CC=C(C=C5)O)C6=CC=C(C=C6)O)C7=CC(=CC(=C7)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy