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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP018482

(10E)-17-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxytricyclo[12.3.1.12,6]nonadeca-1(17),2,4,6(19),10,14(18),15-heptaen-9-one

Formula: C30H36O12  |  Mol. Weight: 588.60 g/mol

IUPAC: (10E)-17-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxytricyclo[12.3.1.12,6]nonadeca-1(17),2,4,6(19),10,14(18),15-heptaen-9-one

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Overview

Molecular Formula C30H36O12
Molecular Weight 588.60 g/mol
Canonical SMILES C1CC2=CC(=C(C=C2)OC3C(C(C(C(O3)CO)O)O)O)C4=C(C=CC(=C4)CCC(=O)C=C1)OC5C(C(C(CO5)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy