小分子和化合物库

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4 项目

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  1. 鬼臼苦素
      规格或纯度 :
    • ≥50%
    CAS号 : 9000-55-9        Compound CID : 11979494
    分子式: C88H92O34        分子量: 1693.65
    IUPAC Name: 8-hydroxy-7-(hydroxymethyl)-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-6-carboxylic acid;5-hydroxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one
    SMILES: COC1=CC(=CC(=C1OC)OC)C2C3C(COC3=O)C(C4=CC5=C(C=C24)OCO5)O.COC1=CC(=CC(=C1OC)OC)C2C3C(COC3=O)C(C4=CC5=C(C=C24)OCO5)O.COC1=CC(=CC(=C1OC)OC)C2C(C(C(C3=CC4=C(C=C23)OCO4)O)CO)C(=O)O.COC1=CC(=CC(=C1OC)OC)C2C(C(C(C3=CC4=C(C=C23)OCO4)O)CO)C(=O)O
    InChIKey: KOUZYZCESNTXJO-UHFFFAOYSA-N
    InChI: InChI=1S/2C22H24O9.2C22H22O8/c2*1-27-16-4-10(5-17(28-2)21(16)29-3)18-11-6-14-15(31-9-30-14)7-12(11)20(24)13(8-23)19(18)22(25)26;2*1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h2*4-7,13,18-20,23-24H,8-9H2,1-3H3,(H,25,26);2*4-7,13,18-20,23H,8-9H2,1-3H3
  2. Fmoc-Gly-OH-¹³C₂,¹⁵N
      规格或纯度 :
    • ≥99 atom% 13C,≥98 atom% 15N
    CAS号 : 285978-13-4        Compound CID : 16213440
    分子式: (H15N-Fmoc)13CH213CO2H        分子量: 300.28
    IUPAC Name: 2-(9H-fluoren-9-ylmethoxycarbonyl(15N)amino)acetic acid
    SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCC(=O)O
    InChIKey: NDKDFTQNXLHCGO-KBBTWOTBSA-N
    InChI: InChI=1S/C17H15NO4/c19-16(20)9-18-17(21)22-10-15-13-7-3-1-5-11(13)12-6-2-4-8-14(12)15/h1-8,15H,9-10H2,(H,18,21)(H,19,20)/i9+1,16+1,18+1
  3. 甘氨酸-1-¹³C,¹⁵N
      规格或纯度 :
    • ≥99 atom% 13C,≥98 atom% 15N
    CAS号 : 112898-03-0        Compound CID : 12999337
    分子式: H215NCH213CO2H        分子量: 77.05
    IUPAC Name: 2-(15N)azanylacetic acid
    SMILES: C(C(=O)O)N
    InChIKey: DHMQDGOQFOQNFH-SUEIGJEOSA-N
    InChI: InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)/i2+1,3+1
  4. 甘氨酸-¹³C₂,¹⁵N
      规格或纯度 :
    • ≥99 atom% 13C,≥98 atom% 15N
    CAS号 : 211057-02-2        Compound CID : 16213439
    分子式: H215N13CH213CO2H        分子量: 78.05
    IUPAC Name: 2-(15N)azanylacetic acid
    SMILES: C(C(=O)O)N
    InChIKey: DHMQDGOQFOQNFH-VMIGTVKRSA-N
    InChI: InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)/i1+1,2+1,3+1
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