Products 1971915-61-3

CAS 1971915-61-3 appears in our catalog under these names: [3-Hydroxy-3-(methoxycarbonyl)-1,5-dioxo-1,5-pentanediyl]bis(oxymethylene-4,1-phenylene) bis[β-D-glucopyranoside], ≥95%, ≥95%, Parishin K. Offered by: Chemat, MedChemExpress. Available pack sizes: 10mg, 20mg, 50mg, 5 mg, 10 mg, 1 mg.

[3-Hydroxy-3-(methoxycarbonyl)-1,5-dioxo-1,5-pentanediyl]bis(oxymethylene-4,1-phenylene) bis[β-D-glucopyranoside], ≥95%, ≥95%
Chemat
  • size: 10mg, 20mg, 50mg
  • Variants: 3
from 1394.00
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Parishin K
MedChemExpress
  • size: 5 mg, 10 mg, 1 mg
  • Variants: 3
from 867.68
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Structural formula: {0} (CAS {1})

2-O-methyl 1-O,3-O-bis[[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl] 2-hydroxypropane-1,2,3-tricarboxylate (CAS 1971915-61-3) is a chemical compound with the molecular formula C33H42O19 and a molecular weight of 742.7 g/mol. IUPAC name: 2-O-methyl 1-O,3-O-bis[[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl] 2-hydroxypropane-1,2,3-tricarboxylate. InChIKey: CDVROTYLMGVUMY-DYDXLFEJSA-N.

Identity
Molecular formulaC33H42O19
Molecular weight742.7 g/mol
IUPAC name2-O-methyl 1-O,3-O-bis[[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl] 2-hydroxypropane-1,2,3-tricarboxylate
InChIKeyCDVROTYLMGVUMY-DYDXLFEJSA-N
SMILESCOC(=O)C(CC(=O)OCC1=CC=C(C=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)(CC(=O)OCC3=CC=C(C=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: Parishin K, orb2564071
Isomers (same molecular formula)
2-[3,4-bis(2-hydroxyethoxy)phenyl]-5-hydroxy-7-(2-hydroxyethoxy)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one C33H42O19
5,7-bis(2-hydroxyethoxy)-2-[3-hydroxy-4-(2-hydroxyethoxy)phenyl]-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one C33H42O19
[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-(4-methoxyphenoxy)-3-[(2S,3S,4S,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl acetate C33H42O19
[(2R,3R,4S,5R,6S)-4,5-diacetyloxy-6-(4-methoxyphenoxy)-3-[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl acetate C33H42O19
(2S)-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-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-2,3-dihydrochromen-4-one C33H42O19