8-o-4-hydroxycinnamoylharpagide, >=95%

cas: 133645-37-1 — see every product listed under this CAS number, including other names

8-o-4-hydroxycinnamoylharpagide, >=95% (CAS 133645-37-1) is a chemical reagent available from Chemat. Available pack sizes: 1MG. Offered by: Sigma-Aldrich.

brandSigma-Aldrich
catalog numberSMB00152-1MG
cas133645-37-1
size1MG
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Sigma-Aldrich 1MG 1524.00 Pln
Structural formula: {0} (CAS {1})

[(4aS,5R,7S)-4a,5-dihydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-7-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate (CAS 133645-37-1) is a chemical compound with the molecular formula C24H30O12 and a molecular weight of 510.5 g/mol. IUPAC name: [(4aS,5R,7S)-4a,5-dihydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-7-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate. InChIKey: AZKQDXZMKREFDY-KZAOYDMLSA-N.

Identity
Molecular formulaC24H30O12
Molecular weight510.5 g/mol
IUPAC name[(4aS,5R,7S)-4a,5-dihydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-7-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
InChIKeyAZKQDXZMKREFDY-KZAOYDMLSA-N
SMILESC[C@@]1(C[C@H]([C@]2(C1C(OC=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O)OC(=O)/C=C/C4=CC=C(C=C4)O

Computed by PubChem (NCBI)

Synonyms: 8-O-4-Hydroxycinnamoylharpagide
Related forms of this compound
[(1S,4aS,5R,7S,7aS)-4a,5-dihydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-7-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate C24H30O12
Isomers (same molecular formula)
[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[(2-phenyl-1,3-dioxan-5-yl)oxy]oxan-2-yl]methyl acetate C24H30O12

Also listed as

8-o-4-Hydroxycinnamoylharpagide Biosynth CAS 133645-37-1