小分子和化合物库
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红海海绵素A(LAT-A)CAS号: 76343-93-6分子式: C22H31NO5S 分子量: 421.55IUPAC Name: (4R)-4-[(1R,4Z,8E,10Z,12S,15R,17R)-17-hydroxy-5,12-dimethyl-3-oxo-2,16-dioxabicyclo[13.3.1]nonadeca-4,8,10-trien-17-yl]-1,3-thiazolidin-2-oneSMILES: CC1CCC2CC(CC(O2)(C3CSC(=O)N3)O)OC(=O)C=C(CCC=CC=C1)CInChIKey: DDVBPZROPPMBLW-IZGXTMSKSA-NInChI: 1S/C22H31NO5S/c1-15-7-5-3-4-6-8-16(2)11-20(24)27-18-12-17(10-9-15)28-22(26,13-18)19-14-29-21(25)23-19/h3-5,7,11,15,17-19,26H,6,8-10,12-14H2,1-2H3,(H,23,25)/b4-3+,7-5-,16-11-/t15-,17-,18-,19+,22-/m1/s1
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D-(-)-3-磷酸甘油二钠盐CAS号: 80731-10-8分子式: C3H5O7P・2Na 分子量: 230.02IUPAC Name: disodium;(2R)-2-hydroxy-3-[hydroxy(oxido)phosphoryl]oxypropanoateSMILES: [Na+].[Na+].O[C@H](COP(O)([O-])=O)C([O-])=OInChIKey: RGCJWQYUZHTJBE-YBBRRFGFSA-LInChI: 1S/C3H7O7P.2Na/c4-2(3(5)6)1-10-11(7,8)9;;/h2,4H,1H2,(H,5,6)(H2,7,8,9);;/q;2*+1/p-2/t2-;;/m1../s1
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N-乙酰基-2,3-脱氢-2-脱氧神经氨酸CAS号: 24967-27-9分子式: C11H17NO8 分子量: 291.26IUPAC Name: (2R,3R,4S)-3-acetamido-4-hydroxy-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acidSMILES: CC(=O)N[C@@H]1[C@@H](O)C=C(O[C@H]1[C@H](O)[C@H](O)CO)C(O)=OInChIKey: JINJZWSZQKHCIP-UFGQHTETSA-NInChI: 1S/C11H17NO8/c1-4(14)12-8-5(15)2-7(11(18)19)20-10(8)9(17)6(16)3-13/h2,5-6,8-10,13,15-17H,3H2,1H3,(H,12,14)(H,18,19)/t5-,6+,8+,9+,10+/m0/s1
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