首页
400-620-6333
小分子和化合物库
选项
-
棕榈酸-1,2,3,4-¹³C₄CAS号: 287100-89-4分子式: CH3(CH2)11(13CH2)313CO2H 分子量: 260.39IUPAC Name: (1,2,3,4-13C4)hexadecanoic acidSMILES: CCCCCCCCCCCCCCCC(=O)OInChIKey: IPCSVZSSVZVIGE-FIZPRHLTSA-NInChI: 1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)/i13+1,14+1,15+1,16+1
-
氯化胆碱-(三甲基-d₉)CAS号: 61037-86-3分子式: HOCH2CH2N(CD3)3Cl 分子量: 148.68IUPAC Name: 2-hydroxyethyl-tris(trideuteriomethyl)azanium;chlorideSMILES: C[N+](C)(C)CCO.[Cl-]InChIKey: SGMZJAMFUVOLNK-KYRNGWDOSA-MInChI: 1S/C5H14NO.ClH/c1-6(2,3)4-5-7;/h7H,4-5H2,1-3H3;1H/q+1;/p-1/i1D3,2D3,3D3;
-
牛磺酸-1,1,2,2-d₄CAS号: 342611-14-7 Compound CID : 49849888分子式: C2H3D4NO3S 分子量: 129.17IUPAC Name: 2-amino-1,1,2,2-tetradeuterioethanesulfonic acidSMILES: C(CS(=O)(=O)O)NInChIKey: XOAAWQZATWQOTB-LNLMKGTHSA-NInChI: 1S/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)/i1D2,2D2
-
生物素-2',2',3',3'-d₄CAS号: 1217850-77-5分子式: C10H12D4N2O3S 分子量: 248.34IUPAC Name: 5-[(4S)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acidSMILES: C1C2C(C(S1)CCCCC(=O)O)NC(=O)N2InChIKey: YBJHBAHKTGYVGT-CRMOQAEOSA-NInChI: 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
-
石胆酸-2,2,4,4-d₄CAS号: 83701-16-0分子式: C24H36D4O3 分子量: 380.60IUPAC Name: (4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-2,2,4,4-tetradeuterio-3-hydroxy-10,13-dimethyl-3,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acidSMILES: [H][C@@]12[C@]([C@](CC([2H])([2H])[C@@H](O)C3([2H])[2H])(C)[C@]3([H])CC2)([H])CC[C@@]4(C)[C@@]1([H])CC[C@]4([H])[C@]([H])(C)CCC(O)=OInChIKey: SMEROWZSTRWXGI-POXZWENPSA-NInChI: 1S/C24H40O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h15-21,25H,4-14H2,1-3H3,(H,26,27)/t15-,16-,17-,18+,19-,20+,21+,23+,24-/m1/s1/i10D2,14D2
-
硬脂酸-¹³C₁₈CAS号: 287100-83-8 Compound CID : 16217539分子式: (¹³C)18H36O2 分子量: 302.35IUPAC Name: (1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18-13C18)octadecanoic acidSMILES: CCCCCCCCCCCCCCCCCC(=O)OInChIKey: QIQXTHQIDYTFRH-HXPQJNGISA-NInChI: 1S/C18H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20)/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1,10+1,11+1,12+1,13+1,14+1,15+1,16+1,17+1,18+1
-
邻苯二甲酸苄基丁基酯-D4CAS号: 93951-88-3分子式: C19D4H16O4 分子量: 316.38IUPAC Name: 2-O-benzyl 1-O-butyl 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylateSMILES: [2H]c1c([2H])c([2H])c(C(=O)OCc2ccccc2)c(c1[2H])C(=O)OCCCCInChIKey: IRIAEXORFWYRCZ-CXRURWBMSA-NInChI: 1S/C19H20O4/c1-2-3-13-22-18(20)16-11-7-8-12-17(16)19(21)23-14-15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3/i7D,8D,11D,12D
