小分子和化合物库

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4 项目

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  1. 雷奈酸锶
      规格或纯度 :
    • ≥98.0%
    CAS号 : 135459-87-9        Compound CID : 6918182
    分子式: C12H6N2O8SSr2        分子量: 513.49
    IUPAC Name: distrontium;5-[bis(carboxylatomethyl)amino]-3-(carboxylatomethyl)-4-cyanothiophene-2-carboxylate
    SMILES: C(C1=C(SC(=C1C#N)N(CC(=O)[O-])CC(=O)[O-])C(=O)[O-])C(=O)[O-].[Sr+2].[Sr+2]
    InChIKey: XXUZFRDUEGQHOV-UHFFFAOYSA-J
    InChI: InChI=1S/C12H10N2O8S.2Sr/c13-2-6-5(1-7(15)16)10(12(21)22)23-11(6)14(3-8(17)18)4-9(19)20;;/h1,3-4H2,(H,15,16)(H,17,18)(H,19,20)(H,21,22);;/q;2*+2/p-4
  2. 1,2-二油酰基-sn-甘油-3-磷酸乙醇胺-N-(生物素)(钠盐)
      规格或纯度 :
    • ≥98.0%
    CAS号 : 384835-53-4        Compound CID : 156593867
    分子式: C51H92N3NaO10PS        分子量: 993.3
    SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)OCCNC(=O)CCCCC1C2C(CS1)NC(=O)N2)OC(=O)CCCCCCCC=CCCCCCCCC.[Na]
    InChIKey: BQZBJHZLJJOUSL-AOAFAMOJSA-N
    InChI: InChI=1S/C51H92N3O10PS.Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-37-48(56)61-41-44(64-49(57)38-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)42-63-65(59,60)62-40-39-52-47(55)36-34-33-35-46-50-45(43-66-46)53-51(58)54-50;/h17-20,44-46,50H,3-16,21-43H2,1-2H3,(H,52,55)(H,59,60)(H2,53,54,58);/b19-17-,20-18-;/t44-,45+,46+,50+;/m1./s1
  3. TUG-424
    CAS号 : 1082058-99-8        Compound CID : 25150014
    分子式: C18H16O2        分子量: 264.32
    IUPAC Name: 3-[4-[2-(2-methylphenyl)ethynyl]phenyl]propanoic acid
    SMILES: CC1=CC=CC=C1C#CC2=CC=C(C=C2)CCC(=O)O
    InChIKey: FODHWOBAQBTTFS-UHFFFAOYSA-N
    InChI: InChI=1S/C18H16O2/c1-14-4-2-3-5-17(14)12-10-15-6-8-16(9-7-15)11-13-18(19)20/h2-9H,11,13H2,1H3,(H,19,20)
  4. L-天冬氨酸-¹⁵N,2,3,3-d₃
      规格或纯度 :
    • ≥98 atom% D,≥98 atom% 15N
    CAS号 : 1308264-52-9       
    分子式: HO2CCD2CD(15NH2)CO2H        分子量: 137.11
    SMILES: [2H]C([2H])(C(O)=O)[C@]([2H])([15NH2])C(O)=O
    InChIKey: CKLJMWTZIZZHCS-GJISNYTCSA-N
    InChI: 1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1/i1D2,2D,5+1
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