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CAS No.	英文名/中文名/SMILES	分子式	分子量
53171-28-1	Quercetin 3-O-(6''-galloyl)-beta-D-galactopyranoside 槲皮素3-O-(6''-没食子酰基)-β-D-半乳糖苷 C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)COC(=O)C5=CC(=C(C(=C5)O)O)O)O)O)O)O)O	C₂₈H₂₄O₁₆	616.5
56316-75-7	Quercetin 3-O-(6''-galloyl)-beta-D-glucopyranoside 槲皮素3-O-(6''-没食子酰基)-β-D-葡萄糖苷 C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)COC(=O)C5=CC(=C(C(=C5)O)O)O)O)O)O)O)O	C₂₈H₂₄O₁₆	616.5
58798-95-1	Bacoside A2 假马齿苋素A2 CC(=CC1COC23CC4(CO2)C(C3C1(C)O)CCC5C4(CCC6C5(CCC(C6(C)C)OC7C(C(C(O7)C(COC8C(C(C(O8)CO)O)O)OC9C(C(C(CO9)O)O)O)O)O)C)C)C	C₄₆H₇₄O₁₇	899.1
64828-40-6	quercetin 3-O-sophoroside-7-O-rhamnoside 槲皮素-3-O-槐二糖-7-O-鼠李糖苷 CC1C(C(C(C(O1)OC2=CC(=C3C(=C2)OC(=C(C3=O)OC4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O)C6=CC(=C(C=C6)O)O)O)O)O)O	C₃₃H₄₀O₂₁	772.7
65639-51-2	10-Hydroxy-3,3-dimethylbenzofuro[3,2-c]pyrano[3,2-g]chromen-7(3H)-one 4",5"-去氢异补骨脂定 CC1(C=CC2=CC3=C(C=C2O1)OC(=O)C4=C3OC5=C4C=CC(=C5)O)C	C₂₀H₁₄O₅	334.3
70868-78-9	19Alpha-Hydroxyasiatic Acid 23-羟基委陵菜酸 CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1(C)O)C)C(=O)O	C₃₀H₄₈O₆	504.7
82508-35-8	pseudolaric acid C2 去甲基土荆皮乙酸 CC(=CC=CC1(C2CCC3(C2(CCC(=CC3)C(=O)O)OC(=O)C)C(=O)O1)C)C(=O)O	C₂₂H₂₆O₈	418.4
847375-46-6	7,3',5'-Trihydroxyflavanone 7,3',5'-三羟基黄烷酮 C1C(OC2=C(C1=O)C=CC(=C2)O)C3=CC(=CC(=C3)O)O	C₁₅H₁₂O₅	272.25
858127-38-5	(3S,4S)-3,4-Bis(4-hydroxy-3-methoxybenzyl)-3-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)dihydrofuran-2(3H)-one 去甲络石苷元8'-O-β-葡萄糖苷 COC1=C(C=CC(=C1)CC2COC(=O)C2(CC3=CC(=C(C=C3)O)OC)OC4C(C(C(C(O4)CO)O)O)O)O	C₂₆H₃₂O₁₂	536.5
883715-23-9	N-((3-Methoxyphenyl)methyl)octadeca-9,12,15-trienamide, (9Z,12Z,15Z)- 间-甲氧基苄基-亚麻酰胺 CCC=CCC=CCC=CCCCCCCCC(=O)NCC1=CC(=CC=C1)OC	C₂₆H₃₉NO₂	397.6