CAS 80159-07-5 to numer rejestracyjny substancji Methyl (1S,4aS,5R,7aS)-7-(hydroxymethyl)-5-(((E)-3-(4-hydroxyphenyl)acryloyl)oxy)-1-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate, 99%. Oferty producentów: BLDpharm. Dostępne opakowania: 1mg, 5mg, 10mg, 25mg, 50mg.
Methyl (1S,4aS,5R,7aS)-7-(hydroxymethyl)-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate (CAS 80159-07-5) to związek chemiczny o wzorze sumarycznym C26H30O13 i masie molowej 550.5 g/mol. Nazwa systematyczna IUPAC: methyl (1S,4aS,5R,7aS)-7-(hydroxymethyl)-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate. InChIKey: ABYPZHZWILXERF-BYMAQSFPSA-N.
| Wzór sumaryczny | C26H30O13 |
|---|---|
| Masa molowa | 550.5 g/mol |
| Nazwa IUPAC | methyl (1S,4aS,5R,7aS)-7-(hydroxymethyl)-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate |
| InChIKey | ABYPZHZWILXERF-BYMAQSFPSA-N |
| SMILES | COC(=O)C1=CO[C@H]([C@H]2[C@@H]1[C@@H](C=C2CO)OC(=O)/C=C/C3=CC=C(C=C3)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O |
Dane obliczone przez PubChem (NCBI)