Products 138213-63-5

CAS 138213-63-5 appears in our catalog under these names: 1,6,2',3',6'–O–Pentaacetyl–3–O–trans–p–coumaroylsucrose, 1,6,2',3',6'-O-Pentaacetyl-3-O-trans-p-coumaroylsucrose. Offered by: GLPBio, MedChemExpress. Available pack sizes: 5mg, Get quote.

Structural formula: {0} (CAS {1})

[(2S,3S,4R,5R)-2,5-bis(acetyloxymethyl)-2-[(2R,3R,4S,5R,6R)-3,4-diacetyloxy-6-(acetyloxymethyl)-5-hydroxyoxan-2-yl]oxy-4-hydroxyoxolan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate (CAS 138213-63-5) is a chemical compound with the molecular formula C31H38O18 and a molecular weight of 698.6 g/mol. IUPAC name: [(2S,3S,4R,5R)-2,5-bis(acetyloxymethyl)-2-[(2R,3R,4S,5R,6R)-3,4-diacetyloxy-6-(acetyloxymethyl)-5-hydroxyoxan-2-yl]oxy-4-hydroxyoxolan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate. InChIKey: XEULPBRTZLSETH-OZNBHJLGSA-N.

Identity
Molecular formulaC31H38O18
Molecular weight698.6 g/mol
IUPAC name[(2S,3S,4R,5R)-2,5-bis(acetyloxymethyl)-2-[(2R,3R,4S,5R,6R)-3,4-diacetyloxy-6-(acetyloxymethyl)-5-hydroxyoxan-2-yl]oxy-4-hydroxyoxolan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
InChIKeyXEULPBRTZLSETH-OZNBHJLGSA-N
SMILESCC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)COC(=O)C)O)OC(=O)/C=C/C3=CC=C(C=C3)O)COC(=O)C)OC(=O)C)OC(=O)C)O

Computed by PubChem (NCBI)