Rubropilosin structure

Rubropilosin

[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-[2-hydroxy-4-(hydroxymethyl)phenoxy]oxan-2-yl]methyl (E)-3-phenylprop-2-enoate

Also Known As: Rubropilosin|2-Hydroxy-4-hydroxymethylphenyl 6-O-cinnamoyl-beta-D-allopyranoside|[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-[2-hydroxy-4-(hydroxymethyl)phenoxy]oxan-2-yl]methyl (E)-3-phenylprop-2-enoate|beta-D-Allopyranoside, 2-hydroxy-4-(hydroxymethyl)phenyl, 6-(3-phenyl-2-propenoate)|[2-Hydroxy-4-(hydroxymethyl)phenyl]6-O-(3-phenyl-1-oxo-2-propenyl)-beta-D-allopyranoside|((2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(2-hydroxy-4-(hydroxymethyl)phenoxy)oxan-2-yl)methyl (E)-3-phenylprop-2-enoate|[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-[2-hydroxy-4-(hydroxymethyl)phenoxy]oxan-2-yl]methyl 3-phenylprop-2-enoate

CAS: 33993-67-8
Molecular Formula C22H24O9
Molecular Weight 432.14203 g/mol
LogP 0.3275
Topological Polar Surface Area 145.91 Ų
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 9
Rotatable Bonds 7
Exact Mass 432.14203
Monoisotopic Mass 432.14203
Heavy Atoms 31
Complexity 899.1095

Chemical Identifiers

CAS Number 33993-67-8
SMILES C1=CC=C(C=C1)/C=C/C(=O)OC[C@@H]2[C@H]([C@H]([C@H]([C@@H](O2)OC3=C(C=C(C=C3)CO)O)O)O)O

Product Overview

Rubropilosin (CAS 33993-67-8), with molecular formula C22H24O9 and molecular weight 432.14203 g/mol. IUPAC: [(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-[2-hydroxy-4-(hydroxymethyl)phenoxy]oxan-2-yl]methyl (E)-3-phenylprop-2-enoate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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