Products 126589-95-5

CAS 126589-95-5 is the registry number for Specioside B. Offered by: Biosynth, MedChemExpress. Available pack sizes: 25mg, 1mg, 5mg, 10mg, 50mg, Get quote.

Specioside B
Biosynth, MedChemExpress
  • size: 25mg, 1mg, 5mg, 10mg
  • Variants: 6
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Structural formula: {0} (CAS {1})

(3Z,5S)-5-hydroxy-4-(4-hydroxyphenyl)-9-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,6-dihydro-1-benzoxocin-2-one (CAS 126589-95-5) is a chemical compound with the molecular formula C23H24O10 and a molecular weight of 460.4 g/mol. IUPAC name: (3Z,5S)-5-hydroxy-4-(4-hydroxyphenyl)-9-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,6-dihydro-1-benzoxocin-2-one. InChIKey: BFKUDGRBSUJNLA-LRYVSMNUSA-N.

Identity
Molecular formulaC23H24O10
Molecular weight460.4 g/mol
IUPAC name(3Z,5S)-5-hydroxy-4-(4-hydroxyphenyl)-9-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,6-dihydro-1-benzoxocin-2-one
InChIKeyBFKUDGRBSUJNLA-LRYVSMNUSA-N
SMILESC1[C@@H](/C(=C\C(=O)OC2=C1C=CC(=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)/C4=CC=C(C=C4)O)O

Computed by PubChem (NCBI)

Synonyms: Specioside B
Isomers (same molecular formula)
methyl (2S,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-naphthalen-2-yloxyoxane-2-carboxylate C23H24O10
methyl (3S,4S,5S,6S)-3,4,5-triacetyloxy-6-naphthalen-1-yloxyoxane-2-carboxylate C23H24O10
7,8-dimethoxy-2-phenyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one C23H24O10
6-methoxy-3-(4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one C23H24O10
7-methoxy-2-(4-methoxyphenyl)-5-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one C23H24O10