小分子和化合物库

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显示第112个,产品总数115

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  1. 芹菜素
    CAS号 : 520-36-5        Compound CID : 5280443
    分子式: C15H10O5        分子量: 270.24
    IUPAC Name: 5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one
    SMILES: C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O
    InChIKey: KZNIFHPLKGYRTM-UHFFFAOYSA-N
    InChI: InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H
  2. 柠檬酸伊沙佐米(MLN9708)
      规格或纯度 :
    • ≥98%
    CAS号 : 1201902-80-8        Compound CID : 49867936
    分子式: C20H23BCl2N2O9        分子量: 517.12
    IUPAC Name: 4-(carboxymethyl)-2-[(1R)-1-[[2-[(2,5-dichlorobenzoyl)amino]acetyl]amino]-3-methylbutyl]-6-oxo-1,3,2-dioxaborinane-4-carboxylic acid
    SMILES: B1(OC(=O)CC(O1)(CC(=O)O)C(=O)O)C(CC(C)C)NC(=O)CNC(=O)C2=C(C=CC(=C2)Cl)Cl
    InChIKey: YTXSYWAKVMZICI-PVCZSOGJSA-N
    InChI: InChI=1S/C20H23BCl2N2O9/c1-10(2)5-14(21-33-17(29)8-20(34-21,19(31)32)7-16(27)28)25-15(26)9-24-18(30)12-6-11(22)3-4-13(12)23/h3-4,6,10,14H,5,7-9H2,1-2H3,(H,24,30)(H,25,26)(H,27,28)(H,31,32)/t14-,20?/m0/s1
  3. CEP-18770 (Delanzomib),蛋白酶体抑制剂
      规格或纯度 :
    • ≥97%
    CAS号 : 847499-27-8        Compound CID : 24800541
    分子式: C21H28BN3O5        分子量: 413.28
    IUPAC Name: [(1R)-1-[[(2S,3R)-3-hydroxy-2-[(6-phenylpyridine-2-carbonyl)amino]butanoyl]amino]-3-methylbutyl]boronic acid
    SMILES: B(C(CC(C)C)NC(=O)C(C(C)O)NC(=O)C1=CC=CC(=N1)C2=CC=CC=C2)(O)O
    InChIKey: SJFBTAPEPRWNKH-CCKFTAQKSA-N
    InChI: InChI=1S/C21H28BN3O5/c1-13(2)12-18(22(29)30)24-21(28)19(14(3)26)25-20(27)17-11-7-10-16(23-17)15-8-5-4-6-9-15/h4-11,13-14,18-19,26,29-30H,12H2,1-3H3,(H,24,28)(H,25,27)/t14-,18+,19+/m1/s1
  4. 胡椒碱
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号 : 7780-20-3        Compound CID : 638024
    分子式: C17H19NO3        分子量: 285.37
    IUPAC Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpenta-2,4-dien-1-one
    SMILES: C1CCN(CC1)C(=O)C=CC=CC2=CC3=C(C=C2)OCO3
    InChIKey: MXXWOMGUGJBKIW-YPCIICBESA-N
    InChI: InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+
  5. Linoleylethanolamide,失活的类似物
    CAS号 : 68171-52-8        Compound CID : 5283446
    分子式: C20H37NO2        分子量: 323.51
    IUPAC Name: (9Z,12Z)-N-(2-hydroxyethyl)octadeca-9,12-dienamide
    SMILES: CCCCCC=CCC=CCCCCCCCC(=O)NCCO
    InChIKey: KQXDGUVSAAQARU-HZJYTTRNSA-N
    InChI: InChI=1S/C20H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)21-18-19-22/h6-7,9-10,22H,2-5,8,11-19H2,1H3,(H,21,23)/b7-6-,10-9-
  6. A 784168,TRPV1拮抗剂
      规格或纯度 :
    • ≥99%
    CAS号 : 824982-41-4        Compound CID : 11420211
    分子式: C19H15F6N3O3S        分子量: 479.40
    IUPAC Name: 1-[3-(trifluoromethyl)pyridin-2-yl]-N-[4-(trifluoromethylsulfonyl)phenyl]-3,6-dihydro-2H-pyridine-4-carboxamide
    SMILES: C1CN(CC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)C(F)(F)F)C3=C(C=CC=N3)C(F)(F)F
    InChIKey: SDUAWRFBHRAFBM-UHFFFAOYSA-N
    InChI: InChI=1S/C19H15F6N3O3S/c20-18(21,22)15-2-1-9-26-16(15)28-10-7-12(8-11-28)17(29)27-13-3-5-14(6-4-13)32(30,31)19(23,24)25/h1-7,9H,8,10-11H2,(H,27,29)
  7. PI 1840
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号 : 1401223-22-0        Compound CID : 56945245
    分子式: C22H26N4O3        分子量: 394.47
    IUPAC Name: N-propan-2-yl-2-(4-propylphenoxy)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide
    SMILES: CCCC1=CC=C(C=C1)OCC(=O)N(CC2=NC(=NO2)C3=CN=CC=C3)C(C)C
    InChIKey: ZVVXAODXPVWGMF-UHFFFAOYSA-N
    InChI: InChI=1S/C22H26N4O3/c1-4-6-17-8-10-19(11-9-17)28-15-21(27)26(16(2)3)14-20-24-22(25-29-20)18-7-5-12-23-13-18/h5,7-13,16H,4,6,14-15H2,1-3H3
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