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二十烷酸-d₃₉酸CAS号: 39756-32-6分子式: CD3(CD2)18COOH 分子量: 351.77IUPAC Name: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,19,19,20,20,20-nonatriacontadeuterioicosanoic acidSMILES: CCCCCCCCCCCCCCCCCCCC(=O)OInChIKey: VKOBVWXKNCXXDE-BKDZISOFSA-NInChI: 1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)/i1D3,2D2,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2,14D2,15D2,16D2,17D2,18D2,19D2
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5-磷酰核糖-1-焦磷酸钠盐CAS号: 108321-05-7 Compound CID : 92043170分子式: C5H8Na5O14P3 分子量: 499.98IUPAC Name: tetrasodium;[[(3R,4S,5R)-3,4-dihydroxy-5-[[hydroxy(oxido)phosphoryl]oxymethyl]oxolan-2-yl]oxy-oxidophosphoryl] phosphateSMILES: C(C1C(C(C(O1)OP(=O)([O-])OP(=O)([O-])[O-])O)O)OP(=O)(O)[O-].[Na+].[Na+].[Na+].[Na+]InChIKey: QZAPPJHVNYCTAX-CKJQBBATSA-JInChI: 1S/C5H13O14P3.4Na/c6-3-2(1-16-20(8,9)10)17-5(4(3)7)18-22(14,15)19-21(11,12)13;;;;/h2-7H,1H2,(H,14,15)(H2,8,9,10)(H2,11,12,13);;;;/q;4*+1/p-4/t2-,3-,4-,5?;;;;/m1..../s1
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S-(5′-腺苷)-L-甲硫氨酸氯化物 二盐酸盐CAS号: 86867-01-8 Compound CID : 71307500分子式: C15H23ClN6O5S · 2 HCl 分子量: 507.82IUPAC Name: [(3S)-3-amino-3-carboxypropyl]-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-methylsulfanium;chloride;dihydrochlorideSMILES: C[S+](CCC(C(=O)O)N)CC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O.Cl.Cl.[Cl-]InChIKey: KBAFOJZCBYWKPU-XQVUROGGSA-NInChI: 1S/C15H22N6O5S.3ClH/c1-27(3-2-7(16)15(24)25)4-8-10(22)11(23)14(26-8)21-6-20-9-12(17)18-5-19-13(9)21;;;/h5-8,10-11,14,22-23H,2-4,16H2,1H3,(H2-,17,18,19,24,25);3*1H/t7-,8+,10+,11+,14+,27?;;;/m0.../s1
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辅酶 A,三锂盐,水合物CAS号: 18439-24-2分子式: C21H33N7O16P3S • XLi [XH2O] 分子量: 764.5（free basis）IUPAC Name: See more
SMILES: [Li+].[Li+].[Li+].CC(C)(COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)[O-])C(C(=O)NCCC(=O)NCCS)OInChIKey: QSCBPHBAFBVXRK-HJKJOZROSA-KInChI: See more -
分散黄7分子式: C19H16N4O 分子量: 316.36IUPAC Name: 2-methyl-4-[(4-phenyldiazenylphenyl)diazenyl]phenolSMILES: CC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)N=NC3=CC=CC=C3)OInChIKey: VGKYEIFFSOPYEW-UHFFFAOYSA-NInChI: 1S/C19H16N4O/c1-14-13-18(11-12-19(14)24)23-22-17-9-7-16(8-10-17)21-20-15-5-3-2-4-6-15/h2-13,24H,1H3
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聚半乳糖醛酸钠盐分子式: C18H23NaO19-2 分子量: 566.4IUPAC Name: sodium;(2S,3R,4S,5R,6S)-6-[(2S,3R,4R,5R,6S)-2-carboxylato-6-[(2S,3R,4R,5R,6S)-2-carboxylato-4,5,6-trihydroxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylateSMILES: C1(C(C(OC(C1O)OC2C(C(C(OC2C(=O)[O-])OC3C(C(C(OC3C(=O)[O-])O)O)O)O)O)C(=O)[O-])O)O.[Na+]InChIKey: NUCACHWVTZGFJN-PYSZDIKSSA-KInChI: See more
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N-乙酰基-9-O-乙酰神经氨酸CAS号: 55717-54-9 Compound CID : 123962分子式: C13H21NO10 分子量: 351.31IUPAC Name: (2S,4S,5R,6R)-5-acetamido-6-[(1R,2R)-3-acetyloxy-1,2-dihydroxypropyl]-2,4-dihydroxyoxane-2-carboxylic acidSMILES: CC(=O)NC1C(CC(OC1C(C(COC(=O)C)O)O)(C(=O)O)O)OInChIKey: NYWZBRWKDRMPAS-GRRZBWEESA-NInChI: 1S/C13H21NO10/c1-5(15)14-9-7(17)3-13(22,12(20)21)24-11(9)10(19)8(18)4-23-6(2)16/h7-11,17-19,22H,3-4H2,1-2H3,(H,14,15)(H,20,21)/t7-,8+,9+,10+,11+,13-/m0/s1
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N-(1-羧乙基)亚氨基二乙酸三钠CAS号: 164462-16-2 Compound CID : 11021984分子式: C7H8NNa3O6 分子量: 271.11IUPAC Name: trisodium;2-[bis(carboxylatomethyl)amino]propanoateSMILES: CC(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+]InChIKey: OHOTVSOGTVKXEL-UHFFFAOYSA-KInChI: 1S/C7H11NO6.3Na/c1-4(7(13)14)8(2-5(9)10)3-6(11)12;;;/h4H,2-3H2,1H3,(H,9,10)(H,11,12)(H,13,14);;;/q;3*+1/p-3
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链脲佐菌素CAS号: 18883-66-4 EC号: 242-646-8分子式: C8H15N3O7 分子量: 265.22IUPAC Name: 1-methyl-1-nitroso-3-[(2S,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]ureaSMILES: CN(C(=O)NC1C(C(C(OC1O)CO)O)O)N=OInChIKey: ZSJLQEPLLKMAKR-GKHCUFPYSA-NInChI: 1S/C8H15N3O7/c1-11(10-17)8(16)9-4-6(14)5(13)3(2-12)18-7(4)15/h3-7,12-15H,2H2,1H3,(H,9,16)/t3-,4-,5-,6-,7+/m1/s1
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7β-hydroxycholesterol-d7CAS号: 349553-97-5分子式: C27H39D7O2 分子量: 409.70IUPAC Name: (3S,7R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6,7,7,7-tetradeuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diolSMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2C(C=C4C3(CCC(C4)O)C)O)CInChIKey: OYXZMSRRJOYLLO-SVAMASIOSA-NInChI: 1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-25-23(12-14-27(21,22)5)26(4)13-11-20(28)15-19(26)16-24(25)29/h16-18,20-25,28-29H,6-15H2,1-5H3/t18-,20+,21-,22+,23+,24+,25+,26+,27-/m1/s1/i1D3,2D3,17D
