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4-甲基伞形酮-β-D-葡糖苷CAS号: 18997-57-4 EC号: 242-736-7分子式: C16H18O8 分子量: 338.31IUPAC Name: 4-methyl-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-oneSMILES: CC1=CC(=O)OC2=C1C=CC(=C2)OC3C(C(C(C(O3)CO)O)O)OInChIKey: YUDPTGPSBJVHCN-YMILTQATSA-NInChI: 1S/C16H18O8/c1-7-4-12(18)23-10-5-8(2-3-9(7)10)22-16-15(21)14(20)13(19)11(6-17)24-16/h2-5,11,13-17,19-21H,6H2,1H3/t11-,13-,14+,15-,16-/m1/s1
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4-甲基伞形酮-β-D-木糖苷分子式: C15H16O7 分子量: 308.28IUPAC Name: 4-methyl-7-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxychromen-2-oneSMILES: CC1=CC(=O)OC2=C1C=CC(=C2)OC3C(C(C(CO3)O)O)OInChIKey: JWIYLOHVJDJZOQ-KAOXEZKKSA-NInChI: 1S/C15H16O7/c1-7-4-12(17)22-11-5-8(2-3-9(7)11)21-15-14(19)13(18)10(16)6-20-15/h2-5,10,13-16,18-19H,6H2,1H3/t10-,13+,14-,15+/m1/s1
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4-甲基伞形酮基α-D-吡喃甘露糖苷CAS号: 28541-83-5 EC号: 249-073-2分子式: C16H18O8 分子量: 338.31IUPAC Name: 4-methyl-7-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-oneSMILES: CC1=CC(=O)OC2=C1C=CC(=C2)OC3C(C(C(C(O3)CO)O)O)OInChIKey: YUDPTGPSBJVHCN-VMMWWAARSA-NInChI: 1S/C16H18O8/c1-7-4-12(18)23-10-5-8(2-3-9(7)10)22-16-15(21)14(20)13(19)11(6-17)24-16/h2-5,11,13-17,19-21H,6H2,1H3/t11-,13-,14+,15+,16+/m1/s1
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葛根素分子式: C21H20O9 分子量: 416.38IUPAC Name: 7-hydroxy-3-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-oneSMILES: C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3C4C(C(C(C(O4)CO)O)O)O)O)OInChIKey: HKEAFJYKMMKDOR-VPRICQMDSA-NInChI: 1S/C21H20O9/c22-7-14-17(26)18(27)19(28)21(30-14)15-13(24)6-5-11-16(25)12(8-29-20(11)15)9-1-3-10(23)4-2-9/h1-6,8,14,17-19,21-24,26-28H,7H2/t14-,17-,18+,19-,21+/m1/s1
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N-邻苯二甲酰甘氨酸分子式: C10H7NO4 分子量: 205.17IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)acetic acidSMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CC(=O)OInChIKey: WQINSVOOIJDOLJ-UHFFFAOYSA-NInChI: 1S/C10H7NO4/c12-8(13)5-11-9(14)6-3-1-2-4-7(6)10(11)15/h1-4H,5H2,(H,12,13)
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托吡酯CAS号: 97240-79-4 Compound CID : 5284627分子式: C12H21NO8S 分子量: 339.36IUPAC Name: [(1R,2S,6S,9R)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecan-6-yl]methyl sulfamateSMILES: CC1(OC2COC3(C(C2O1)OC(O3)(C)C)COS(=O)(=O)N)CInChIKey: KJADKKWYZYXHBB-XBWDGYHZSA-NInChI: 1S/C12H21NO8S/c1-10(2)18-7-5-16-12(6-17-22(13,14)15)9(8(7)19-10)20-11(3,4)21-12/h7-9H,5-6H2,1-4H3,(H2,13,14,15)/t7-,8-,9+,12+/m1/s1
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代他考昔CAS号: 181695-72-7 Compound CID : 119607分子式: C16H14N2O3S 分子量: 314.36IUPAC Name: 4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)benzenesulfonamideSMILES: CC1=C(C(=NO1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)NInChIKey: LNPDTQAFDNKSHK-UHFFFAOYSA-NInChI: 1S/C16H14N2O3S/c1-11-15(12-7-9-14(10-8-12)22(17,19)20)16(18-21-11)13-5-3-2-4-6-13/h2-10H,1H3,(H2,17,19,20)
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塞来昔布CAS号: 169590-42-5 EC号: 685-962-5分子式: C17H14F3N3O2S 分子量: 381.37IUPAC Name: 4-[5-(4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamideSMILES: CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)FInChIKey: RZEKVGVHFLEQIL-UHFFFAOYSA-NInChI: 1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25)
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木犀草素分子式: C15H10O6 分子量: 286.24IUPAC Name: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-oneSMILES: C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)OInChIKey: IQPNAANSBPBGFQ-UHFFFAOYSA-NInChI: 1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H
