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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP038282

(1R,3S,4S,5S,6R,10R,11S,12S,13R,17R,18S,19S,20R)-4,5,18,19,20-pentahydroxy-3-(hydroxymethyl)-11,12-bis(4-hydroxyphenyl)-2,8,15,21,22-pentaoxatetracyclo[15.3.1.13,6.010,13]docosane-9,14-dione

Formula: C30H34O15  |  Mol. Weight: 634.60 g/mol

IUPAC: (1R,3S,4S,5S,6R,10R,11S,12S,13R,17R,18S,19S,20R)-4,5,18,19,20-pentahydroxy-3-(hydroxymethyl)-11,12-bis(4-hydroxyphenyl)-2,8,15,21,22-pentaoxatetracyclo[15.3.1.13,6.010,13]docosane-9,14-dione

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Overview

Molecular Formula C30H34O15
Molecular Weight 634.60 g/mol
Canonical SMILES C1C2C(C(C(C(O2)OC3(C(C(C(O3)COC(=O)C4C(C(C4C(=O)O1)C5=CC=C(C=C5)O)C6=CC=C(C=C6)O)O)O)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy