Products 35775-46-3

CAS 35775-46-3 appears in our catalog under these names: Chrysin 7–O–neohesperidoside, Chrysin7-O-neohesperidoside. Offered by: GLPBio, MedChemExpress. Available pack sizes: 5mg, Get quote.

Chrysin 7–O–neohesperidoside
GLPBio
  • size: 5mg
  • Variants: 1
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Chrysin7-O-neohesperidoside
MedChemExpress
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Structural formula: {0} (CAS {1})

7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-phenylchromen-4-one (CAS 35775-46-3) is a chemical compound with the molecular formula C27H30O13 and a molecular weight of 562.5 g/mol. IUPAC name: 7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-phenylchromen-4-one. InChIKey: IJJFWUJRFABXCN-QVNVHUMTSA-N.

Identity
Molecular formulaC27H30O13
Molecular weight562.5 g/mol
IUPAC name7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-phenylchromen-4-one
InChIKeyIJJFWUJRFABXCN-QVNVHUMTSA-N
SMILESC[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC=CC=C5)O)CO)O)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: Chrysin 7-O-neohesperidoside, Chrysin7-O-neohesperidoside, orb1680394
Isomers (same molecular formula)
(5S,5aR,8aR,9R)-9-(4-hydroxy-3,5-dimethoxyphenyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one C27H30O13
3-(4-methoxyphenyl)-7-[(2S,4S,5S)-3,4,5-trihydroxy-6-[[(2S,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one C27H30O13
7-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-(4-methoxyphenyl)chromen-4-one C27H30O13
7-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-3-(4-methoxyphenyl)chromen-4-one C27H30O13