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苹果酸阿莫曲坦CAS号: 181183-52-8分子式: C17H25N3O2S·C4H6O5 分子量: 469.55IUPAC Name: N,N-dimethyl-2-[5-(pyrrolidin-1-ylsulfonylmethyl)-1H-indol-3-yl]ethanamine;2-hydroxybutanedioic acidSMILES: CN(C)CCC1=CNC2=C1C=C(C=C2)CS(=O)(=O)N3CCCC3.C(C(C(=O)O)O)C(=O)OInChIKey: QHATUKWEVNMHRY-UHFFFAOYSA-NInChI: 1S/C17H25N3O2S.C4H6O5/c1-19(2)10-7-15-12-18-17-6-5-14(11-16(15)17)13-23(21,22)20-8-3-4-9-20;5-2(4(8)9)1-3(6)7/h5-6,11-12,18H,3-4,7-10,13H2,1-2H3;2,5H,1H2,(H,6,7)(H,8,9)
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腺嘌呤核苷分子式: C10H13N5O4 分子量: 267.24IUPAC Name: (2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diolSMILES: C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)NInChIKey: OIRDTQYFTABQOQ-KQYNXXCUSA-NInChI: 1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1
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L-抗坏血酸棕榈酸酯分子式: C22H38O7 分子量: 414.53IUPAC Name: [(2S)-2-[(2R)-3,4-dihydroxy-5-oxo-2H-furan-2-yl]-2-hydroxyethyl] hexadecanoateSMILES: CCCCCCCCCCCCCCCC(=O)OCC(C1C(=C(C(=O)O1)O)O)OInChIKey: QAQJMLQRFWZOBN-LAUBAEHRSA-NInChI: 1S/C22H38O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(24)28-16-17(23)21-19(25)20(26)22(27)29-21/h17,21,23,25-26H,2-16H2,1H3/t17-,21+/m0/s1
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腺苷-5′-二磷酸 钠盐CAS号: 20398-34-9 Compound CID : 12797869分子式: C10H15N5O10P2.xNa 分子量: 427.20(free)IUPAC Name: trisodium;[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] phosphateSMILES: [Na].Nc1ncnc2n(cnc12)C3OC(COP(O)(=O)OP(O)(O)=O)C(O)C3OInChIKey: KWEUUBDPVVHQAL-MSQVLRTGSA-KInChI: See more
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3-延胡素酸氨基丙腈酯分子式: (C3H6N2)2·C4H4O4 分子量: 256.26IUPAC Name: 3-aminopropanenitrile;(E)-but-2-enedioic acidSMILES: C(CN)C#N.C(CN)C#N.C(=CC(=O)O)C(=O)OInChIKey: NYMXYZMHOZAPHQ-SEPHDYHBSA-NInChI: 1S/C4H4O4.2C3H6N2/c5-3(6)1-2-4(7)8;2*4-2-1-3-5/h1-2H,(H,5,6)(H,7,8);2*1-2,4H2/b2-1+;;
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1-(1-金刚烷基)乙基胺盐酸盐CAS号: 1501-84-4分子式: C12H21N.HCl 分子量: 215.77IUPAC Name: 1-(1-adamantyl)ethanamine;hydrochlorideSMILES: CC(C12CC3CC(C1)CC(C3)C2)N.ClInChIKey: OZBDFBJXRJWNAV-UHFFFAOYSA-NInChI: 1S/C12H21N.ClH/c1-8(13)12-5-9-2-10(6-12)4-11(3-9)7-12;/h8-11H,2-7,13H2,1H3;1H
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A-769662,AMP激活的蛋白激酶激活剂CAS号: 844499-71-4分子式: C20H12N2O3S 分子量: 360.39IUPAC Name: 4-hydroxy-3-[4-(2-hydroxyphenyl)phenyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrileSMILES: C1=CC=C(C(=C1)C2=CC=C(C=C2)C3=CSC4=C3C(=C(C(=O)N4)C#N)O)OInChIKey: CTESJDQKVOEUOY-UHFFFAOYSA-NInChI: 1S/C20H12N2O3S/c21-9-14-18(24)17-15(10-26-20(17)22-19(14)25)12-7-5-11(6-8-12)13-3-1-2-4-16(13)23/h1-8,10,23H,(H2,22,24,25)
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乙酸阿比特龙酯CAS号: 154229-18-2分子式: C26H33NO2 分子量: 391.55IUPAC Name: [(3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-pyridin-3-yl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetateSMILES: CC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CC=C4C5=CN=CC=C5)C)CInChIKey: UVIQSJCZCSLXRZ-UBUQANBQSA-NInChI: 1S/C26H33NO2/c1-17(28)29-20-10-12-25(2)19(15-20)6-7-21-23-9-8-22(18-5-4-14-27-16-18)26(23,3)13-11-24(21)25/h4-6,8,14,16,20-21,23-24H,7,9-13,15H2,1-3H3/t20-,21-,23-,24-,25-,26+/m0/s1
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土木香内酯CAS号: 546-43-0分子式: C15H20O2 分子量: 232.32IUPAC Name: (3aR,5S,8aR,9aR)-5,8a-dimethyl-3-methylidene-5,6,7,8,9,9a-hexahydro-3aH-benzo[f][1]benzofuran-2-oneSMILES: CC1CCCC2(C1=CC3C(C2)OC(=O)C3=C)CInChIKey: PXOYOCNNSUAQNS-AGNJHWRGSA-NInChI: 1S/C15H20O2/c1-9-5-4-6-15(3)8-13-11(7-12(9)15)10(2)14(16)17-13/h7,9,11,13H,2,4-6,8H2,1,3H3/t9-,11+,13+,15+/m0/s1
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1-花生酰-2-羟基-sn-甘油-3-磷酸胆碱CAS号: 108341-80-6分子式: C28H58NO7P 分子量: 551.736IUPAC Name: [(2R)-2-hydroxy-3-icosanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphateSMILES: CCCCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OInChIKey: UATOAILWGVYRQS-HHHXNRCGSA-NInChI: 1S/C28H58NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-28(31)34-25-27(30)26-36-37(32,33)35-24-23-29(2,3)4/h27,30H,5-26H2,1-4H3/t27-/m1/s1
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