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L-刀豆氨酸硫酸盐分子式: C5H12N4O3·H2SO4·xH2O 分子量: 274.25(as Anhydrous)IUPAC Name: (2S)-2-amino-4-(diaminomethylideneamino)oxybutanoic acid;sulfuric acidSMILES: C(CON=C(N)N)C(C(=O)O)N.OS(=O)(=O)OInChIKey: MVIPJKVMOKFIEV-DFWYDOINSA-NInChI: InChI=1S/C5H12N4O3.H2O4S/c6-3(4(10)11)1-2-12-9-5(7)8;1-5(2,3)4/h3H,1-2,6H2,(H,10,11)(H4,7,8,9);(H2,1,2,3,4)/t3-;/m0./s1
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头孢美唑钠CAS号 : 56796-39-5 Compound CID : 23666711分子式: C15H16N7NaO5S3 分子量: 493.51IUPAC Name: sodium;(6R,7S)-7-[[2-(cyanomethylsulfanyl)acetyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylateSMILES: CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)(NC(=O)CSCC#N)OC)SC2)C(=O)[O-].[Na+]InChIKey: BITQGIOJQWZUPL-PBCQUBLHSA-MInChI: InChI=1S/C15H17N7O5S3.Na/c1-21-14(18-19-20-21)30-6-8-5-29-13-15(27-2,17-9(23)7-28-4-3-16)12(26)22(13)10(8)11(24)25;/h13H,4-7H2,1-2H3,(H,17,23)(H,24,25);/q;+1/p-1/t13-,15+;/m1./s1
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1,3-丙二磺酸二钠CAS号 : 36589-58-9分子式: C3H6Na2O6S2 分子量: 248.17IUPAC Name: disodium;propane-1,3-disulfonateSMILES: C(CS(=O)(=O)[O-])CS(=O)(=O)[O-].[Na+].[Na+]InChIKey: DKGJFKPIUSHDIT-UHFFFAOYSA-LInChI: InChI=1S/C3H8O6S2.2Na/c4-10(5,6)2-1-3-11(7,8)9;;/h1-3H2,(H,4,5,6)(H,7,8,9);;/q;2*+1/p-2
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肉豆蔻酸-1-（¹³C）CAS号 : 57677-52-8 Compound CID : 16213484分子式: C13(13C)H28O2 分子量: 229.36IUPAC Name: (113C)tetradecanoic acidSMILES: CCCCCCCCCCCCCC(=O)OInChIKey: TUNFSRHWOTWDNC-UJKGMGNHSA-NInChI: InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16)/i14+1
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马拉硫磷-d6CAS号 : 1189877-72-2分子式: C10H13D6O6PS2 分子量: 336.39IUPAC Name: diethyl 2-[bis(trideuteriomethoxy)phosphinothioylsulfanyl]butanedioateSMILES: CCOC(=O)CC(C(=O)OCC)SP(=S)(OC)OCInChIKey: JXSJBGJIGXNWCI-LIJFRPJRSA-NInChI: InChI=1S/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3/i3D3,4D3
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25-羟基维生素D₃-23,24,25,26,27-¹³C₅溶液CAS号 : 19356-17-3 Compound CID : 5283731分子式: C27H44O2 分子量: 400.64IUPAC Name: (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-olSMILES: CC(CCCC(C)(C)O)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)CInChIKey: JWUBBDSIWDLEOM-DTOXIADCSA-NInChI: InChI=1S/C27H44O2/c1-19-10-13-23(28)18-22(19)12-11-21-9-7-17-27(5)24(14-15-25(21)27)20(2)8-6-16-26(3,4)29/h11-12,20,23-25,28-29H,1,6-10,13-18H2,2-5H3/b21-11+,22-12-/t20-,23+,24-,25+,27-/m1/s1
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L-赖氨酸-¹³C₆盐酸盐CAS号 : 1228077-86-8 Compound CID : 16217566分子式: H2N(13CH2)413CH(NH2)13CO2H·HCl 分子量: 188.6IUPAC Name: (2S)-2,6-diamino(1,2,3,4,5,6-13C6)hexanoic acid;hydrochlorideSMILES: C(CCN)CC(C(=O)O)N.ClInChIKey: BVHLGVCQOALMSV-BOBMYJBMSA-NInChI: InChI=1S/C6H14N2O2.ClH/c7-4-2-1-3-5(8)6(9)10;/h5H,1-4,7-8H2,(H,9,10);1H/t5-;/m0./s1/i1+1,2+1,3+1,4+1,5+1,6+1;
