小分子和化合物库

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  1. [1-13C]-α-D-吡喃半乳糖磷酸二钾盐
      规格或纯度 :
    • ≥99 atom% 13C,≥98%
    CAS号: 478518-78-4        Compound CID : 90472755
    分子式: (13-C)C5H11O9PK2        分子量: 337.31
    IUPAC Name: dipotassium;[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)(213C)oxan-2-yl] phosphate
    SMILES: C(C1C(C(C(C(O1)OP(=O)([O-])[O-])O)O)O)O.[K+].[K+]
    InChIKey: KCIDZIIHRGYJAE-HLZBLTOGSA-L
    InChI: 1S/C6H13O9P.2K/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13;;/h2-10H,1H2,(H2,11,12,13);;/q;2*+1/p-2/t2-,3+,4+,5-,6-;;/m1../s1/i6+1;;
  2. 龙胆紫-d6
      规格或纯度 :
    • ≥98%,≥98 atom% D
    CAS号: 1266676-01-0
    分子式: C25H24D6ClN3        分子量: 414.02
    IUPAC Name: [4-[bis[4-(dimethylamino)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-bis(trideuteriomethyl)azanium;chloride
    SMILES: CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.[Cl-]
    InChIKey: ZXJXZNDDNMQXFV-TXHXQZCNSA-M
    InChI: 1S/C25H30N3.ClH/c1-26(2)22-13-7-19(8-14-22)25(20-9-15-23(16-10-20)27(3)4)21-11-17-24(18-12-21)28(5)6;/h7-18H,1-6H3;1H/q+1;/p-1/i1D3,2D3;
  3. 亚麻酸-13C18
      规格或纯度 :
    • ≥98 atom% 13C18,≥95%
    CAS号: 287111-28-8
    分子式: (13C)18H30O2        分子量: 296.3
    IUPAC Name: (9Z,12Z,15Z)-(1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18-13C18)octadeca-9,12,15-trienoic acid
    SMILES: CCC=CCC=CCC=CCCCCCCCC(=O)O
    InChIKey: DTOSIQBPPRVQHS-JHNAZIRYSA-N
    InChI: 1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10H,2,5,8,11-17H2,1H3,(H,19,20)/b4-3-,7-6-,10-9-/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+1See more
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