Produkty 1063818-55-2
CAS 1063818-55-2 to numer rejestracyjny substancji petunidin-3-O-(6-O-p-coumaroyl)glucoside-5-O-diglucoside, ≥98%. Oferty producentów: Chemat. Dostępne opakowania: 5mg.
[(2R,3S,4S,5R,6S)-6-[2-(3,4-dihydroxy-5-methoxyphenyl)-7-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate (CAS 1063818-55-2) to związek chemiczny o wzorze sumarycznym C37H39O19+ i masie molowej 787.7 g/mol. Nazwa systematyczna IUPAC: [(2R,3S,4S,5R,6S)-6-[2-(3,4-dihydroxy-5-methoxyphenyl)-7-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate. InChIKey: ZGMRIMVMTYZQLM-LIVDWXSESA-O.
| Wzór sumaryczny | C37H39O19+ |
|---|---|
| Masa molowa | 787.7 g/mol |
| Nazwa IUPAC | [(2R,3S,4S,5R,6S)-6-[2-(3,4-dihydroxy-5-methoxyphenyl)-7-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate |
| InChIKey | ZGMRIMVMTYZQLM-LIVDWXSESA-O |
| SMILES | COC1=CC(=CC(=C1O)O)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)COC(=O)/C=C/C6=CC=C(C=C6)O)O)O)O |
Dane obliczone przez PubChem (NCBI)