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CAS No.	英文名/中文名/SMILES	分子式	分子量
2673-40-7	Perivine 派利文碱 CC=C1CNC2CC3=C(C(=O)CC1C2C(=O)OC)NC4=CC=CC=C34	C₂₀H₂₂N₂O₃	338.4
77035-42-8	Dehydroeburicoic acid monoacetate 去氢齿孔酸乙酰酯 CC(C)C(=C)CCC(C1CCC2(C1(CC=C3C2=CCC4C3(CCC(C4(C)C)OC(=O)C)C)C)C)C(=O)O	C₃₃H₅₀O₄	510.7
130430-97-6	1-[2-[[3-(Trifluoromethyl)phenyl]methoxy]ethyl]-4-[[3-(trifluoromethyl)phenyl]methyl]piperazine 辛辣内酯A C1CN(CCN1CCOCC2=CC(=CC=C2)C(F)(F)F)CC3=CC(=CC=C3)C(F)(F)F	C₂₂H₂₄F₆N₂O	446.4
133882-74-3	Soyosaponin Ac 大豆皂苷Ac CC1C(C(C(C(O1)OC2C(C(C(OC2OC3C(C(C(OC3OC4CCC5(C(C4(C)CO)CCC6(C5CC=C7C6(CCC8(C7CC(C(C8OC9C(C(C(CO9)O)OC1C(C(C(C(O1)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)O)O)(C)C)C)C)C)C)C(=O)O)O)O)CO)O)O)O)O)O	C₆₇H₁₀₄O₃₂	1421.5
135272-91-2	Sandosaponin A 大豆皂苷Bd CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(C(=O)C1)C)C)C)(C)CO)OC6C(C(C(C(O6)C(=O)O)O)O)OC7C(C(C(C(O7)CO)O)O)OC8C(C(C(C(O8)CO)O)O)O)C)C	C₄₈H₇₆O₁₉	957.1
117210-14-7	Dehydrosoyasaponin I 大豆皂苷Be CC1C(C(C(C(O1)OC2C(C(C(OC2OC3C(C(C(OC3OC4CCC5(C(C4(C)CO)CCC6(C5CC=C7C6(CCC8(C7CC(CC8=O)(C)C)C)C)C)C)C(=O)O)O)O)CO)O)O)O)O)O	C₄₈H₇₆O₁₈	941.1
117210-13-6	Soyasaponin Be methyl Ester 大豆皂苷Be甲酯 CC1C(C(C(C(O1)OC2C(C(C(OC2OC3C(C(C(OC3OC4CCC5(C(C4(C)CO)CCC6(C5CC=C7C6(CCC8(C7CC(CC8=O)(C)C)C)C)C)C)C(=O)OC)O)O)CO)O)O)O)O)O	C₄₉H₇₈O₁₈	955.1
65604-99-1	(2R,3S,4R,5S)-2-[(2S,3S,4R,5S,6S)-2-[(1R,2S,3Ar,5'S,5aR,5bR,9R,11aS,11bR,13aR,13bS)-1,5',11a,13a-tetramethylspiro[3a,4,5,5a,5b,6,8,9,10,11,11b,12,13,13b-tetradecahydro-1H-phenanthro[2,1-e][1]benzofuran-2,2'-oxane]-9-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxyoxane-3,4,5-triol 薯蓣皂苷元-3-O-β-D-木糖-(1→3) -β-D-葡萄糖苷 CC1CCC2(C(C3C(O2)CCC4C3(CCC5C4CC=C6C5(CCC(C6)OC7C(C(C(C(O7)CO)O)OC8C(C(C(CO8)O)O)O)O)C)C)C)OC1	C₃₉H₆₂O₁₂	722.9
116521-73-4	(S)-Moluccanin - COC1=CC(=CC(=C1O)OC)C2C(OC3=C(O2)C=C4C(=C3)C=CC(=O)O4)CO	C₂₀H₁₈O₈	386.4
1983-72-8	Medicagol 苜蓿内酯 C1OC2=C(O1)C=C3C(=C2)C4=C(O3)C5=C(C=C(C=C5)O)OC4=O	C₁₆H₈O₆	296.23