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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP005005

(2S,3R,4S,5R)-2-[[(2S,3S,4aR,4bS,7R,8aS)-7-[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-ethenyl-2,4b,8,8-tetramethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-3-yl]oxy]oxane-3,4,5-triol

Formula: C30H48O10  |  Mol. Weight: 568.70 g/mol

IUPAC: (2S,3R,4S,5R)-2-[[(2S,3S,4aR,4bS,7R,8aS)-7-[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-ethenyl-2,4b,8,8-tetramethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-3-yl]oxy]oxane-3,4,5-triol

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Overview

Molecular Formula C30H48O10
Molecular Weight 568.70 g/mol
Canonical SMILES CC1(C2CCC3=CC(C(CC3C2(CCC1OC4C(C(C(O4)CO)O)O)C)OC5C(C(C(CO5)O)O)O)(C)C=C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy