68795-37-9 (芍药苷-3-葡萄糖苷,Peonidin-3-glucosid)

快速询单

结构式：

芍药苷-3-葡萄糖苷MOL文件

CAS号：

68795-37-9

中文名称：

芍药苷-3-葡萄糖苷

英文名称：

Peonidin-3-glucosid

分子式：

C₂₂H₂₃O₁₁

分子量：

463.411427736282

植物源：

黑茶藨子黑涩石楠

芍药苷-3-葡萄糖苷(68795-37-9)名称与标识符

名称

英文别名：

Peonidin-3-glucosid;Q6625055;68795-37-9;5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-benzopyran-1-ium-3-yl hexopyranoside;5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1$l^{4}-chromen-1-ylium;5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1lambda4-benzopyran-1-ylium;CHEMBL1784263;3-(beta-D-Glucopyranosyloxy)-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-benzopyrylium;CHEBI:74793;Peonidin-3-glucoside;Peonidin 3-beta-D-glucoside;(2S,3S,4R,5S,6R)-2-(Hydroxymethyl)-6-(2-(3-methoxy-4-oxidanyl-phenyl)-5,7-bis(oxidanyl)chromenylium-3-yl)oxy-oxane-3,4,5-triol;D5ZBS8SDA7;(2S,3R,4S,5S,6R)-2-[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;3'-O-methylcyanidin 3-O-beta-D-glucoside;DTXSID70988503;peonidin 3-O-beta-D-glucoside;5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromenium-3-yl beta-D-glucopyranoside;1-Benzopyrylium, 3-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-;

标识符

InChIKey：

ZZWPMFROUHHAKY-OUUKCGNVSA-O

Inchi：

1S/C22H22O11/c1-30-15-4-9(2-3-12(15)25)21-16(7-11-13(26)5-10(24)6-14(11)31-21)32-22-20(29)19(28)18(27)17(8-23)33-22/h2-7,17-20,22-23,27-29H,8H2,1H3,(H2-,24,25,26)/p+1/t17-,18-,19+,20-,22-/m1/s1

SMILES：

O1[C@H]([C@@H]([C@H]([C@@H]([C@H]1CO)O)O)O)OC1=CC2C(=CC(=CC=2[O+]=C1C1C=CC(=C(C=1)OC)O)O)O