小分子和化合物库

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显示第112个,产品总数161

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  1. 醋酸氢化可的松
      规格或纯度 :
    • ≥98%
    CAS号 : 50-03-3        Compound CID : 5744
    分子式: C23H32O6        分子量: 404.5
    IUPAC Name: [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
    SMILES: CC(=O)OCC(=O)C1(CCC2C1(CC(C3C2CCC4=CC(=O)CCC34C)O)C)O
    InChIKey: ALEXXDVDDISNDU-JZYPGELDSA-N
    InChI: InChI=1S/C23H32O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h10,16-18,20,26,28H,4-9,11-12H2,1-3H3/t16-,17-,18-,20+,21-,22-,23-/m0/s1
  2. 4-孕烯-3,11,20-三酮
      规格或纯度 :
    • ≥97%
    CAS号 : 516-15-4        Compound CID : 94166
    分子式: C21H28O3        分子量: 328.456
    IUPAC Name: (8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
    SMILES: CC(=O)C1CCC2C1(CC(=O)C3C2CCC4=CC(=O)CCC34C)C
    InChIKey: WKAVAGKRWFGIEA-DADBAOPHSA-N
    InChI: InChI=1S/C21H28O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h10,15-17,19H,4-9,11H2,1-3H3/t15-,16+,17-,19+,20-,21+/m0/s1
  3. 醛甾酮 标准液
      规格或纯度 :
    • 100 μg/mL in acetonitrile
    CAS号 : 52-39-1        Compound CID : 5839
    分子式: C21H28O5        分子量: 360.44
    IUPAC Name: (8S,9S,10R,11S,13R,14S,17S)-11-hydroxy-17-(2-hydroxyacetyl)-10-methyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-13-carbaldehyde
    SMILES: CC12CCC(=O)C=C1CCC3C2C(CC4(C3CCC4C(=O)CO)C=O)O
    InChIKey: PQSUYGKTWSAVDQ-ZVIOFETBSA-N
    InChI: InChI=1S/C21H28O5/c1-20-7-6-13(24)8-12(20)2-3-14-15-4-5-16(18(26)10-22)21(15,11-23)9-17(25)19(14)20/h8,11,14-17,19,22,25H,2-7,9-10H2,1H3/t14-,15-,16+,17-,19+,20-,21+/m0/s1
  4. 泼尼松龙
      规格或纯度 :
    • ≥98%
    CAS号 : 50-24-8        Compound CID : 5755
    分子式: C21H28O5        分子量: 360.44
    IUPAC Name: (8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one
    SMILES: CC12CC(C3C(C1CCC2(C(=O)CO)O)CCC4=CC(=O)C=CC34C)O
    InChIKey: OIGNJSKKLXVSLS-VWUMJDOOSA-N
    InChI: InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1
  5. TC-G 1004
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号 : 1061747-72-5        Compound CID : 25074316
    分子式: C22H27N7O2        分子量: 421.5
    IUPAC Name: N-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)pyridin-2-yl]pyrimidin-4-yl]acetamide
    SMILES: CC1=CC(=NN1C2=NC(=CC(=N2)NC(=O)C)C3=NC(=CC=C3)N4CCC(CC4)OC)C
    InChIKey: JENSDTKXNVHSSN-UHFFFAOYSA-N
    InChI: InChI=1S/C22H27N7O2/c1-14-12-15(2)29(27-14)22-25-19(13-20(26-22)23-16(3)30)18-6-5-7-21(24-18)28-10-8-17(31-4)9-11-28/h5-7,12-13,17H,8-11H2,1-4H3,(H,23,25,26,30)
  6. LUF 5834,腺苷A2A和A2B受体部分激动剂
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号 : 333962-91-7        Compound CID : 135543624
    分子式: C17H12N6OS        分子量: 348.38
    IUPAC Name: 2-amino-4-(4-hydroxyphenyl)-6-(1H-imidazol-2-ylmethylsulfanyl)pyridine-3,5-dicarbonitrile
    SMILES: C1=CC(=CC=C1C2=C(C(=NC(=C2C#N)SCC3=NC=CN3)N)C#N)O
    InChIKey: OFHKDLYFKPBXER-UHFFFAOYSA-N
    InChI: InChI=1S/C17H12N6OS/c18-7-12-15(10-1-3-11(24)4-2-10)13(8-19)17(23-16(12)20)25-9-14-21-5-6-22-14/h1-6,24H,9H2,(H2,20,23)(H,21,22)
  7. 7-氯-4-羟基-2-苯基-1,8-萘啶
    CAS号 : 286411-09-4        Compound CID : 6105572
    分子式: C14H9N2OCl        分子量: 256.69
    IUPAC Name: 7-chloro-2-phenyl-1H-1,8-naphthyridin-4-one
    SMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(N2)N=C(C=C3)Cl
    InChIKey: JSCUNIPKMPNPFX-UHFFFAOYSA-N
    InChI: InChI=1S/C14H9ClN2O/c15-13-7-6-10-12(18)8-11(16-14(10)17-13)9-4-2-1-3-5-9/h1-8H,(H,16,17,18)
  8. CAY10680
      规格或纯度 :
    • ≥98%
    CAS号 : 1439488-21-7        Compound CID : 71680733
    分子式: C18H16N2O2S        分子量: 324.40
    IUPAC Name: N-(4-oxo-3,1-benzothiazin-2-yl)-4-phenylbutanamide
    SMILES: C1=CC=C(C=C1)CCCC(=O)NC2=NC3=CC=CC=C3C(=O)S2
    InChIKey: QMBOZLGNPMVERZ-UHFFFAOYSA-N
    InChI: InChI=1S/C18H16N2O2S/c21-16(12-6-9-13-7-2-1-3-8-13)20-18-19-15-11-5-4-10-14(15)17(22)23-18/h1-5,7-8,10-11H,6,9,12H2,(H,19,20,21)
  9. 5'-氨基-5'- 脱氧腺苷
      规格或纯度 :
    • ≥95%
    CAS号 : 14365-44-7        Compound CID : 9816781
    分子式: C10H14N6O3        分子量: 266.26
    IUPAC Name: (2R,3S,4R,5R)-2-(aminomethyl)-5-(6-aminopurin-9-yl)oxolane-3,4-diol
    SMILES: C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CN)O)O)N
    InChIKey: GVSGUDGNTHCZHI-KQYNXXCUSA-N
    InChI: InChI=1S/C10H14N6O3/c11-1-4-6(17)7(18)10(19-4)16-3-15-5-8(12)13-2-14-9(5)16/h2-4,6-7,10,17-18H,1,11H2,(H2,12,13,14)/t4-,6-,7-,10-/m1/s1
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