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小分子和化合物库
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核黄素磷酸钠分子式: C17H20N4NaO9P 分子量: 478.33IUPAC Name: sodium;[(2R,3S,4S)-5-(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] hydrogen phosphateSMILES: CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(COP(=O)(O)[O-])O)O)O.[Na+]InChIKey: OHSHFZJLPYLRIP-BMZHGHOISA-MInChI: 1S/C17H21N4O9P.Na/c1-7-3-9-10(4-8(7)2)21(15-13(18-9)16(25)20-17(26)19-15)5-11(22)14(24)12(23)6-30-31(27,28)29;/h3-4,11-12,14,22-24H,5-6H2,1-2H3,(H,20,25,26)(H2,27,28,29);/q;+1/p-1/t11-,12+,14-;/m0./s1
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(3E， 8Z， 11Z)-十四烷-3， 8， 11三烯-1-基乙酸酯分子式: C16H26O2 分子量: 250.38IUPAC Name: [(3E,8Z,11Z)-tetradeca-3,8,11-trienyl] acetateSMILES: CCC=CCC=CCCCC=CCCOC(=O)CInChIKey: HWPJPNQEVWTZSJ-XBZOLNABSA-NInChI: 1S/C16H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-16(2)17/h4-5,7-8,12-13H,3,6,9-11,14-15H2,1-2H3/b5-4-,8-7-,13-12+
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共轭亚油酸分子式: C18H32O2 分子量: 280.45IUPAC Name: (10E,12Z)-octadeca-10,12-dienoic acidSMILES: CCCCCC=CC=CCCCCCCCCC(=O)OInChIKey: GKJZMAHZJGSBKD-NMMTYZSQSA-NInChI: 1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-9H,2-5,10-17H2,1H3,(H,19,20)/b7-6-,9-8+
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L-2-磷酸甘油酸 二钠盐CAS号: 23295-92-3分子式: C3H5Na2O7P · xH2O 分子量: 230.02 (anhydrous basis)IUPAC Name: (2S)-3-hydroxy-2-phosphonooxypropanoic acidSMILES: C([C@@H](C(=O)O)OP(=O)(O)O)OInChIKey: GXIURPTVHJPJLF-REOHCLBHSA-NInChI: 1S/C3H7O7P/c4-1-2(3(5)6)10-11(7,8)9/h2,4H,1H2,(H,5,6)(H2,7,8,9)/t2-/m0/s1
