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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP032130

(1R,28R,31R,48S)-6,7,8,11,17,18,19,30,36,37,38,41,42,43-tetradecahydroxy-2,13,21,26,29,32,47-heptaoxanonacyclo[26.20.0.04,9.010,24.012,22.015,20.031,48.034,39.040,45]octatetraconta-4,6,8,10,12(22),15,17,19,23,34,36,38,40,42,44-pentadecaene-3,14,25,33,46-pentone

Formula: C41H26O26  |  Mol. Weight: 934.60 g/mol

IUPAC: (1R,28R,31R,48S)-6,7,8,11,17,18,19,30,36,37,38,41,42,43-tetradecahydroxy-2,13,21,26,29,32,47-heptaoxanonacyclo[26.20.0.04,9.010,24.012,22.015,20.031,48.034,39.040,45]octatetraconta-4,6,8,10,12(22),15,17,19,23,34,36,38,40,42,44-pentadecaene-3,14,25,33,46-pentone

Overview

Molecular Formula C41H26O26
Molecular Weight 934.60 g/mol
Canonical SMILES C1C2C(C3C(C(O2)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C(C=C5C(=O)O3)O)O)O)O)O)O)OC(=O)C6=CC(=C(C(=C6C7=C(C8=C(C=C7C(=O)O1)OC9=C(C(=C(C=C9C(=O)O8)O)O)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy