小分子和化合物库

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  1. 丙酸氟替卡松-d5
      规格或纯度 :
    • ≥92%,≥95 atom% D
    CAS号 : 1093258-28-6        Compound CID : 91820603
    分子式: C25H26F3O5SD5        分子量: 505.61
    IUPAC Name: [(6S,8S,9R,10S,11S,13S,14S,16R,17R)-6,9-difluoro-17-(fluoromethylsulfanylcarbonyl)-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] 2,2,3,3,3-pentadeuteriopropanoate
    SMILES: CCC(=O)OC1(C(CC2C1(CC(C3(C2CC(C4=CC(=O)C=CC43C)F)F)O)C)C)C(=O)SCF
    InChIKey: WMWTYOKRWGGJOA-AMTWIDTLSA-N
    InChI: InChI=1S/C25H31F3O5S/c1-5-20(31)33-25(21(32)34-12-26)13(2)8-15-16-10-18(27)17-9-14(29)6-7-22(17,3)24(16,28)19(30)11-23(15,25)4/h6-7,9,13,15-16,18-19,30H,5,8,10-12H2,1-4H3/t13-,15+,16+,18+,19+,22+,23+,24+,25+/m1/s1/i1D3,5D2
  2. L-丙氨酸-¹³C₃,¹⁵N
      规格或纯度 :
    • ≥98 atom% 15N,≥98 atom% 13C
    CAS号 : 202407-38-3        Compound CID : 16213447
    分子式: 13CH313CH(15NH2)13CO2H        分子量: 93.06
    IUPAC Name: (2S)-2-(15N)azanyl(1,2,3-13C3)propanoic acid
    SMILES: CC(C(=O)O)N
    InChIKey: QNAYBMKLOCPYGJ-UVYXLFMMSA-N
    InChI: InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1+1,2+1,3+1,4+1
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