首页
400-620-6333
小分子和化合物库
选项
-
盐酸利达脒d3CAS号: 65009-35-0(unlabeled)分子式: C11H14D3ClN4O 分子量: 259.75SMILES: Cl.[2H]C([2H])([2H])NC(=N)NC(=O)Nc1c(C)cccc1C
-
乙酰水杨酸-d4CAS号: 97781-16-3分子式: C9H4D4O4 分子量: 184.18IUPAC Name: 2-acetyloxy-3,4,5,6-tetradeuteriobenzoic acidSMILES: CC(=O)OC1=CC=CC=C1C(=O)OInChIKey: BSYNRYMUTXBXSQ-QFFDRWTDSA-NInChI: 1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)/i2D,3D,4D,5D
-
尼美舒利-d5CAS号: 1330180-22-7 Compound CID : 71750951分子式: C13H7D5N2O5S 分子量: 313.34IUPAC Name: N-[4-nitro-2-(2,3,4,5,6-pentadeuteriophenoxy)phenyl]methanesulfonamideSMILES: CS(NC(C=CC([N+]([O-])=O)=C1)=C1OC2=C([2H])C([2H])=C([2H])C([2H])=C2[2H])(=O)=OInChIKey: HYWYRSMBCFDLJT-VIQYUKPQSA-NInChI: 1S/C13H12N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h2-9,14H,1H3/i2D,3D,4D,5D,6D
-
-
焦磷酸铜（II）水合物CAS号: 304671-71-4 Compound CID : 16212263分子式: Cu₂P₂O₇·xH₂O (x≈₃-₄)IUPAC Name: dicopper;phosphonato phosphate;hydrateSMILES: O.[O-]P(=O)([O-])OP(=O)([O-])[O-].[Cu+2].[Cu+2]InChIKey: PXZSJEBZWADSIY-UHFFFAOYSA-JInChI: 1S/2Cu.H4O7P2.H2O/c;;1-8(2,3)7-9(4,5)6;/h;;(H2,1,2,3)(H2,4,5,6);1H2/q2*+2;;/p-4
-
达沙替尼-d8CAS号: 1132093-70-9分子式: C22H18D8ClN7O2S 分子量: 496.05IUPAC Name: N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[2,2,3,3,5,5,6,6-octadeuterio-4-(2-hydroxyethyl)piperazin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamideSMILES: CC1=C(C(=CC=C1)Cl)NC(=O)C2=CN=C(S2)NC3=CC(=NC(=N3)C)N4CCN(CC4)CCOInChIKey: ZBNZXTGUTAYRHI-COMRDEPKSA-NInChI: 1S/C22H26ClN7O2S/c1-14-4-3-5-16(23)20(14)28-21(32)17-13-24-22(33-17)27-18-12-19(26-15(2)25-18)30-8-6-29(7-9-30)10-11-31/h3-5,12-13,31H,6-11H2,1-2H3,(H,28,32)(H,24,25,26,27)/i6D2,7D2,8D2,9D2
-
-
-
(S)-反-2-氨基-4-(2-氨基乙氧基)-3-丁烯酸 盐酸盐CAS号: 55720-26-8分子式: C6H12N2O3 · HCl 分子量: 196.63IUPAC Name: (E,2S)-2-amino-4-(2-aminoethoxy)but-3-enoic acid;hydrochlorideSMILES: C(COC=CC(C(=O)O)N)N.ClInChIKey: ZDCPLYVEFATMJF-BTIOQYSDSA-NInChI: 1S/C6H12N2O3.ClH/c7-2-4-11-3-1-5(8)6(9)10;/h1,3,5H,2,4,7-8H2,(H,9,10);1H/b3-1+;/t5-;/m0./s1
-
-
磷烯醇丙酮酸 环己铵盐CAS号: 10526-80-4 EC号: 234-084-7分子式: C3H4O6P · C6H14N 分子量: 267.22IUPAC Name: cyclohexanamine;2-phosphonooxyprop-2-enoic acidSMILES: C=C(C(=O)O)OP(=O)(O)O.C1CCC(CC1)NInChIKey: VHFCNZDHPABZJO-UHFFFAOYSA-NInChI: 1S/C6H13N.C3H5O6P/c7-6-4-2-1-3-5-6;1-2(3(4)5)9-10(6,7)8/h6H,1-5,7H2;1H2,(H,4,5)(H2,6,7,8)
-
β-甘油磷酸钠五水合物（β-GP）CAS号: 13408-09-8 EC号: 212-464-3分子式: C3H7Na2O6P·5H2O 分子量: 306.11IUPAC Name: disodium;1,3-dihydroxypropan-2-yl phosphate;pentahydrateSMILES: C(C(CO)OP(=O)([O-])[O-])O.O.O.O.O.O.[Na+].[Na+]InChIKey: PEMUISUYOHQFQH-UHFFFAOYSA-LInChI: 1S/C3H9O6P.2Na.5H2O/c4-1-3(2-5)9-10(6,7)8;;;;;;;/h3-5H,1-2H2,(H2,6,7,8);;;5*1H2/q;2*+1;;;;;/p-2
