10–O–Coumaroyl–10–O–deacetylasperuloside

cas: 903519-82-4 — see every product listed under this CAS number, including other names

10–O–Coumaroyl–10–O–deacetylasperuloside (CAS 903519-82-4) is a chemical reagent available from Chemat. Available pack sizes: 1mg. Offered by: GLPBio.

brandGLPBio
catalog numberGF44612-1mg
cas903519-82-4
size1mg
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Available pack sizes

brand size price
GLPBio 1mg 1617.39 Pln

properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

[(4S,7S,8S,11S)-2-oxo-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[5.3.1.04,11]undeca-1(10),5-dien-6-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate (CAS 903519-82-4) is a chemical compound with the molecular formula C25H26O12 and a molecular weight of 518.5 g/mol. IUPAC name: [(4S,7S,8S,11S)-2-oxo-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[5.3.1.04,11]undeca-1(10),5-dien-6-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate. InChIKey: JXFDBOBLMXBLDZ-ULUBWVSDSA-N.

Identity
Molecular formulaC25H26O12
Molecular weight518.5 g/mol
IUPAC name[(4S,7S,8S,11S)-2-oxo-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[5.3.1.04,11]undeca-1(10),5-dien-6-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate
InChIKeyJXFDBOBLMXBLDZ-ULUBWVSDSA-N
SMILESC1=CC(=CC=C1/C=C/C(=O)OCC2=C[C@H]3[C@H]4[C@@H]2[C@@H](OC=C4C(=O)O3)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: 10-O-Coumaroyl-10-O-deacetylasperuloside, orb1683946
Isomers (same molecular formula)
(2S,3S,4E)-4-[(4-hydroxyphenyl)methylidene]-2-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-5-oxooxolane-3-carboxylic acid C25H26O12

Also listed as

10-o-Coumaroyl-10-o-deacetylasperuloside Biosynth CAS 903519-82-4