Name: Pinocembrin 7-O-[3''-O-galloyl-4'',6''-hexahydroxydiphenoyl]-β-D-glucoside
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

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HIT ID:HIT213840706
Cas No:205370-59-8
常用名:Pinocembrin 7-O-[3''-O-galloyl-4'',6''-hexahydroxydiphenoyl]-β-D-glucoside
常用名:Pinocembrin 7-O-[3''-O-galloyl-4'',6''-hexahydroxydiphenoyl]-β-D-glucoside
别名:pinocembrin-7-o-3-o-galloyl-4-6-hexahydroxydiphenoyl-beta-d-glucoside, Pinocembrin 7-O-(3''-galloyl-4'',6''-(S)-hexahydroxydiphenoyl)-beta-D-glucose
别名:pinocembrin-7-o-3-o-galloyl-4-6-hexahydroxydiphenoyl-beta-d-glucoside, Pinocembrin 7-O-(3''-galloyl-4'',6''-(S)-hexahydroxydiphenoyl)-beta-D-glucose
IUPAC:3,4,5,12,21,22,23-heptahydroxy-13-[(5-hydroxy-4-oxo-2-phenyl-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]-8,18-dioxo-9,14,17-trioxatetracyclo[17.4.0.0^{2,7}.0^{10,15}]tricosa-1(19),2(7),3,5,20,22-hexaen-11-yl 3,4,5-trihydroxybenzoate
IUPAC:3,4,5,12,21,22,23-heptahydroxy-13-[(5-hydroxy-4-oxo-2-phenyl-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]-8,18-dioxo-9,14,17-trioxatetracyclo[17.4.0.0^{2,7}.0^{10,15}]tricosa-1(19),2(7),3,5,20,22-hexaen-11-yl 3,4,5-trihydroxybenzoate
InChI key:HJEXOQUMFMERIM-UHFFFAOYSA-N

分子式:C42H32O21
分子量:872.697
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:OC1C(Oc2cc(O)c3C(=O)CC(Oc3c2)c2ccccc2)OC2COC(=O)c3cc(O)c(O)c(O)c3-c3c(O)c(O)c(O)cc3C(=O)OC2C1OC(=O)c1cc(O)c(O)c(O)c1
SMILES:OC1C(Oc2cc(O)c3C(=O)CC(Oc3c2)c2ccccc2)OC2COC(=O)c3cc(O)c(O)c(O)c3-c3c(O)c(O)c(O)cc3C(=O)OC2C1OC(=O)c1cc(O)c(O)c(O)c1

Pinocembrin 7-O-[3''-O-galloyl-4'',6''-hexahydroxydiphenoyl]-β-D-glucoside 可抑制 α-淀粉酶活性，IC50值为0.03 umol/ml。

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