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小分子和化合物库
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L-谷氨酸钠,一水分子式: C5H8NO4Na•H2O 分子量: 187.13IUPAC Name: sodium;(4S)-4-amino-5-hydroxy-5-oxopentanoate;hydrateSMILES: C(CC(=O)[O-])C(C(=O)O)N.O.[Na+]InChIKey: GJBHGUUFMNITCI-QTNFYWBSSA-MInChI: InChI=1S/C5H9NO4.Na.H2O/c6-3(5(9)10)1-2-4(7)8;;/h3H,1-2,6H2,(H,7,8)(H,9,10);;1H2/q;+1;/p-1/t3-;;/m0../s1
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D-(+)-海藻糖 二水合物分子式: C12H22O11·2H2O 分子量: 378.33IUPAC Name: (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-3,4,5-triol;dihydrateSMILES: [H]O[H].[H]O[H].OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1OInChIKey: DPVHGFAJLZWDOC-PVXXTIHASA-NInChI: InChI=1S/C12H22O11.2H2O/c13-1-3-5(15)7(17)9(19)11(21-3)23-12-10(20)8(18)6(16)4(2-14)22-12;;/h3-20H,1-2H2;2*1H2/t3-,4-,5-,6-,7+,8+,9-,10-,11-,12-;;/m1../s1
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生物素分子式: C10H16N2O3S 分子量: 244.31IUPAC Name: 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acidSMILES: [H][C@]12CS[C@@H](CCCCC(O)=O)[C@@]1([H])NC(=O)N2InChIKey: YBJHBAHKTGYVGT-ZKWXMUAHSA-NInChI: InChI=1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-/m0/s1
