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  1. 厄达替尼(JNJ-42756493)
    CAS号 : 1346242-81-6        Compound CID : 67462786
    分子式: C25H30N6O2        分子量: 446.54
    IUPAC Name: N'-(3,5-dimethoxyphenyl)-N'-[3-(1-methylpyrazol-4-yl)quinoxalin-6-yl]-N-propan-2-ylethane-1,2-diamine
    SMILES: CC(C)NCCN(C1=CC2=NC(=CN=C2C=C1)C3=CN(N=C3)C)C4=CC(=CC(=C4)OC)OC
    InChIKey: OLAHOMJCDNXHFI-UHFFFAOYSA-N
    InChI: InChI=1S/C25H30N6O2/c1-17(2)26-8-9-31(20-10-21(32-4)13-22(11-20)33-5)19-6-7-23-24(12-19)29-25(15-27-23)18-14-28-30(3)16-18/h6-7,10-17,26H,8-9H2,1-5H3
  2. D-葡萄糖-¹³C₆,1,2,3,4,5,6,6-d₇
      规格或纯度 :
    • ≥99 atom% 13C,≥97 atom% D,≥98%
    CAS号 : 201417-01-8        Compound CID : 71777455
    分子式: 13C6H5D7O6        分子量: 193.15
    IUPAC Name: (2R,3S,4R,5R)-1,2,3,4,5,6,6-heptadeuterio-2,3,4,5,6-pentahydroxy(1,2,3,4,5,6-13C6)hexan-1-one
    SMILES: C(C(C(C(C(C=O)O)O)O)O)O
    InChIKey: GZCGUPFRVQAUEE-VVZLUFAVSA-N
    InChI: InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,3-6,8-12H,2H2/t3-,4+,5+,6+/m0/s1/i1+1D,2+1D2,3+1D,4+1D,5+1D,6+1D
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