小分子和化合物库

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显示第112个,产品总数24

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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: 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. D-葡萄糖-2-¹³C
      规格或纯度 :
    • ≥99 atom% 13C,≥98%
    CAS号 : 105931-74-6        Compound CID : 12285870
    分子式: C6H12O6        分子量: 181.15
    IUPAC Name: (3R,4S,5S,6R)-6-(hydroxymethyl)(313C)oxane-2,3,4,5-tetrol
    SMILES: C(C1C(C(C(C(O1)O)O)O)O)O
    InChIKey: WQZGKKKJIJFFOK-UKLRSMCWSA-N
    InChI: InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6?/m1/s1/i5+1
  3. N-溴代乙酰胺
      规格或纯度 :
    • ≥97%(N)
    CAS号 : 79-15-2        Compound CID : 4353
    分子式: C2H4BrNO        分子量: 137.96
    IUPAC Name: N-bromoacetamide
    SMILES: CC(=O)NBr
    InChIKey: VBTQNRFWXBXZQR-UHFFFAOYSA-N
    InChI: InChI=1S/C2H4BrNO/c1-2(5)4-3/h1H3,(H,4,5)
  4. 亚油酸-1-13C
      规格或纯度 :
    • ≥99 atom% 13C,≥98%
    CAS号 : 98353-71-0        Compound CID : 12311286
    分子式: C1713CH32O2        分子量: 281.44
    IUPAC Name: (9Z,12Z)-(113C)octadeca-9,12-dienoic acid
    SMILES: CCCCCC=CCC=CCCCCCCCC(=O)O
    InChIKey: OYHQOLUKZRVURQ-LKLZSCEKSA-N
    InChI: InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-/i18+1
  5. D-[UL-¹³C6]甘露醇
      规格或纯度 :
    • ≥99 atom% 13C,≥98%
    CAS号 : 287112-34-9       
    分子式: (13C)6H14O6        分子量: 188.13
    IUPAC Name: (2R,3R,4R,5R)-(1,2,3,4,5,6-13C6)hexane-1,2,3,4,5,6-hexol
    SMILES: C(C(C(C(C(CO)O)O)O)O)O
    InChIKey: FBPFZTCFMRRESA-CRWJSTOYSA-N
    InChI: InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4-,5-,6-/m1/s1/i1+1,2+1,3+1,4+1,5+1,6+1
  6. D-葡萄糖-¹³C₆
      规格或纯度 :
    • ≥99 atom% 13C,≥98%
    CAS号 : 110187-42-3        Compound CID : 3086538
    分子式: 13C6H12O6        分子量: 186.11
    IUPAC Name: 2,3,4,5,6-pentahydroxy(1,2,3,4,5,6-13C6)hexanal
    SMILES: C(C(C(C(C(C=O)O)O)O)O)O
    InChIKey: GZCGUPFRVQAUEE-IDEBNGHGSA-N
    InChI: InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,3-6,8-12H,2H2/i1+1,2+1,3+1,4+1,5+1,6+1
  7. L-[6-¹³C]岩藻糖
      规格或纯度 :
    • ≥99 atom% 13C,≥98%
    CAS号 : 478518-51-3        Compound CID : 90472747
    分子式: 13CC5H12O5        分子量: 165.15
    IUPAC Name: (3S,4R,5S,6S)-6-(113C)methyloxane-2,3,4,5-tetrol
    SMILES: CC1C(C(C(C(O1)O)O)O)O
    InChIKey: SHZGCJCMOBCMKK-BUCMHYPRSA-N
    InChI: InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6?/m0/s1/i1+1
  8. 丙烯酰胺-¹³C₃
      规格或纯度 :
    • ≥99 atom% 13C,≥98%
    CAS号 : 287399-26-2        Compound CID : 71308872
    分子式: 13C3H5NO        分子量: 74.06
    IUPAC Name: (1,2,3-13C3)prop-2-enamide
    SMILES: C=CC(=O)N
    InChIKey: HRPVXLWXLXDGHG-VMIGTVKRSA-N
    InChI: InChI=1S/C3H5NO/c1-2-3(4)5/h2H,1H2,(H2,4,5)/i1+1,2+1,3+1
  9. D-葡萄糖-3-¹³C
      规格或纯度 :
    • ≥99 atom% 13C,≥98%
    CAS号 : 287100-64-5        Compound CID : 10035228
    分子式: 13CC5H12O6        分子量: 181.15
    IUPAC Name: (2S,3R,4S,5S,6R)-6-(hydroxymethyl)(413C)oxane-2,3,4,5-tetrol
    SMILES: C(C1C(C(C(C(O1)O)O)O)O)O
    InChIKey: WQZGKKKJIJFFOK-KTESCNBYSA-N
    InChI: InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1/i4+1
  10. L-脯氨酸-13C
      规格或纯度 :
    • ≥99 atom% 13C,≥98%
    CAS号 : 81202-06-4       
    分子式: C5H9NO2        分子量: 116.12
    IUPAC Name: (2S)-pyrrolidine-2-carboxylic acid
    SMILES: C1CC(NC1)C(=O)O
    InChIKey: ONIBWKKTOPOVIA-TXZHAAMZSA-N
    InChI: InChI=1S/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1/i5+1
  11. L-丙氨酸-2-¹³C
      规格或纯度 :
    • ≥99 atom% 13C,≥98%
    CAS号 : 62656-85-3        Compound CID : 16213340
    分子式: CH313CH(NH2)CO2H        分子量: 90.09
    IUPAC Name: (2S)-2-amino(213C)propanoic acid
    SMILES: CC(C(=O)O)N
    InChIKey: QNAYBMKLOCPYGJ-JACJRKFSSA-N
    InChI: InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i2+1
  12. L-丝氨酸-1-¹³C
      规格或纯度 :
    • ≥99 atom% 13C,≥98%
    CAS号 : 81201-84-5        Compound CID : 134039
    分子式: HOCH2CH(NH2)13CO2H        分子量: 106.09
    IUPAC Name: (2S)-2-amino-3-hydroxy(113C)propanoic acid
    SMILES: C(C(C(=O)O)N)O
    InChIKey: MTCFGRXMJLQNBG-NSQKCYGPSA-N
    InChI: InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i3+1
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