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. 潮霉素B
      规格或纯度 :
    • ≥60%(HPLC)
    • Powder
    CAS号: 31282-04-9
    分子式: C20H37N3O13        分子量: 527.52
    IUPAC Name: (2S,3'R,3aS,4S,4'S,5'R,6R,6'R,7S,7aS)-4-[(1R,2S,3R,5S,6R)-3-amino-2,6-dihydroxy-5-(methylamino)cyclohexyl]oxy-6'-[(1R)-1-amino-2-hydroxyethyl]-6-(hydroxymethyl)spiro[4,6,7,7a-tetrahydro-3aH-[1,3]dioxoSee more
    SMILES: CNC1CC(C(C(C1O)OC2C3C(C(C(O2)CO)O)OC4(O3)C(C(C(C(O4)C(CO)N)O)O)O)O)N
    InChIKey: GRRNUXAQVGOGFE-XKIAHZFYSA-N
    InChI: 1S/C20H37N3O13/c1-23-7-2-5(21)9(26)15(10(7)27)33-19-17-16(11(28)8(4-25)32-19)35-20(36-17)18(31)13(30)12(29)14(34-20)6(22)3-24/h5-19,23-31H,2-4,21-22H2,1H3/t5-,6-,7+,8-,9+,10-,11+,12-,13+,14-,15-,16+,1See more
  3. 3, 3'-二碘-L-甲状腺素-(苯氧基-¹³C₆) (T2) 盐酸盐
      规格或纯度 :
    • ≥99 atom% 13C,≥97%
    CAS号: 1217459-13-6
    分子式: C913C6H13I2NO4        分子量: 531.03
    IUPAC Name: (2S)-2-amino-3-[4-(4-hydroxy-3-iodo(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)oxy-3-iodophenyl]propanoic acid
    SMILES: C1=CC(=C(C=C1CC(C(=O)O)N)I)OC2=CC(=C(C=C2)O)I
    InChIKey: CPCJBZABTUOGNM-USQDWSSZSA-N
    InChI: 1S/C15H13I2NO4/c16-10-7-9(2-3-13(10)19)22-14-4-1-8(5-11(14)17)6-12(18)15(20)21/h1-5,7,12,19H,6,18H2,(H,20,21)/t12-/m0/s1/i2+1,3+1,7+1,9+1,10+1,13+1
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