Products 1246012-27-0

CAS 1246012-27-0 appears in our catalog under these names: 4'–O–trans–p–Coumaroylmussaenoside, 4'-O-trans-p-Coumaroylmussaenoside. Offered by: GLPBio, MedChemExpress. Available pack sizes: 5mg, Get quote.

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

Methyl (1S,4aS,7S,7aS)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxyoxan-2-yl]oxy-7-hydroxy-7-methyl-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate (CAS 1246012-27-0) is a chemical compound with the molecular formula C26H32O12 and a molecular weight of 536.5 g/mol. IUPAC name: methyl (1S,4aS,7S,7aS)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxyoxan-2-yl]oxy-7-hydroxy-7-methyl-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate. InChIKey: FGEXYXJRRAKWIL-KPFFXFJGSA-N.

Identity
Molecular formulaC26H32O12
Molecular weight536.5 g/mol
IUPAC namemethyl (1S,4aS,7S,7aS)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxyoxan-2-yl]oxy-7-hydroxy-7-methyl-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate
InChIKeyFGEXYXJRRAKWIL-KPFFXFJGSA-N
SMILESC[C@@]1(CC[C@H]2[C@@H]1[C@@H](OC=C2C(=O)OC)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)OC(=O)/C=C/C4=CC=C(C=C4)O)O)O)O

Computed by PubChem (NCBI)