小分子和化合物库

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显示第112个,产品总数212

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  1. AR-42,HDAC抑制剂
      规格或纯度 :
    • ≥98%
    CAS号 : 935881-37-1        Compound CID : 6918848
    分子式: C18H20N2O3        分子量: 312.36
    IUPAC Name: N-hydroxy-4-[[(2S)-3-methyl-2-phenylbutanoyl]amino]benzamide
    SMILES: CC(C)C(C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)C(=O)NO
    InChIKey: LAMIXXKAWNLXOC-INIZCTEOSA-N
    InChI: InChI=1S/C18H20N2O3/c1-12(2)16(13-6-4-3-5-7-13)18(22)19-15-10-8-14(9-11-15)17(21)20-23/h3-12,16,23H,1-2H3,(H,19,22)(H,20,21)/t16-/m0/s1
  2. 柚皮素
    CAS号 : 480-41-1        Compound CID : 439246
    分子式: C15H12O5        分子量: 272.25
    IUPAC Name: (2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
    SMILES: C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O
    InChIKey: FTVWIRXFELQLPI-ZDUSSCGKSA-N
    InChI: InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2/t13-/m0/s1
  3. PCI-34051,HDAC8抑制剂
      规格或纯度 :
    • ≥98%
    CAS号 : 950762-95-5        Compound CID : 24753719
    分子式: C17H16N2O3        分子量: 296.32
    IUPAC Name: N-hydroxy-1-[(4-methoxyphenyl)methyl]indole-6-carboxamide
    SMILES: COC1=CC=C(C=C1)CN2C=CC3=C2C=C(C=C3)C(=O)NO
    InChIKey: AJRGHIGYPXNABY-UHFFFAOYSA-N
    InChI: InChI=1S/C17H16N2O3/c1-22-15-6-2-12(3-7-15)11-19-9-8-13-4-5-14(10-16(13)19)17(20)18-21/h2-10,21H,11H2,1H3,(H,18,20)
  4. 槲皮素 3-β-D-葡萄糖甙
      规格或纯度 :
    • ≥90%(HPLC)
    CAS号 : 482-35-9        Compound CID : 5280804
    分子式: C21H20O12        分子量: 464.38
    IUPAC Name: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
    SMILES: C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O
    InChIKey: OVSQVDMCBVZWGM-QSOFNFLRSA-N
    InChI: InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18-,21+/m1/s1
  5. 银锻苷
    CAS号 : 20316-62-5        Compound CID : 5320686
    分子式: C30H26O13        分子量: 594.52
    IUPAC Name: [(2R,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate
    SMILES: C1=CC(=CC=C1C=CC(=O)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O
    InChIKey: DVGGLGXQSFURLP-VWMSDXGPSA-N
    InChI: InChI=1S/C30H26O13/c31-16-6-1-14(2-7-16)3-10-22(35)40-13-21-24(36)26(38)27(39)30(42-21)43-29-25(37)23-19(34)11-18(33)12-20(23)41-28(29)15-4-8-17(32)9-5-15/h1-12,21,24,26-27,30-34,36,38-39H,13H2/b10-3+/t21-,24-,26+,27-,30+/m1/s1
  6. 3,4-二羟基苯甲酸乙酯
      规格或纯度 :
    • ≥98%
    CAS号 : 3943-89-3        Compound CID : 77547
    分子式: C9H10O4        分子量: 182.18
    IUPAC Name: ethyl 3,4-dihydroxybenzoate
    SMILES: CCOC(=O)C1=CC(=C(C=C1)O)O
    InChIKey: KBPUBCVJHFXPOC-UHFFFAOYSA-N
    InChI: InChI=1S/C9H10O4/c1-2-13-9(12)6-3-4-7(10)8(11)5-6/h3-5,10-11H,2H2,1H3
  7. 组胺
    CAS号 : 51-45-6        Compound CID : 774
    分子式: C5H9N3        分子量: 111.15
    IUPAC Name: 2-(1H-imidazol-5-yl)ethanamine
    SMILES: C1=C(NC=N1)CCN
    InChIKey: NTYJJOPFIAHURM-UHFFFAOYSA-N
    InChI: InChI=1S/C5H9N3/c6-2-1-5-3-7-4-8-5/h3-4H,1-2,6H2,(H,7,8)
  8. 柚皮素
      规格或纯度 :
    • ≥97%
    CAS号 : 480-41-1        Compound CID : 439246
    分子式: C15H12O5        分子量: 272.25
    IUPAC Name: (2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
    SMILES: C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O
    InChIKey: FTVWIRXFELQLPI-ZDUSSCGKSA-N
    InChI: InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2/t13-/m0/s1
  9. 对香豆酸乙酯
      规格或纯度 :
    • ≥98%
    CAS号 : 7362-39-2        Compound CID : 676946
    分子式: C11H12O3        分子量: 192.21
    IUPAC Name: ethyl (E)-3-(4-hydroxyphenyl)prop-2-enoate
    SMILES: CCOC(=O)C=CC1=CC=C(C=C1)O
    InChIKey: ZOQCEVXVQCPESC-VMPITWQZSA-N
    InChI: InChI=1S/C11H12O3/c1-2-14-11(13)8-5-9-3-6-10(12)7-4-9/h3-8,12H,2H2,1H3/b8-5+
  10. BRD 73954,双组蛋白脱乙酰基酶(HDAC)6/8抑制剂
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号 : 1440209-96-0        Compound CID : 71680913
    分子式: C16H16N2O3        分子量: 284.31
    IUPAC Name: 3-N-hydroxy-1-N-(2-phenylethyl)benzene-1,3-dicarboxamide
    SMILES: C1=CC=C(C=C1)CCNC(=O)C2=CC(=CC=C2)C(=O)NO
    InChIKey: FIHKWEQJEDRIFS-UHFFFAOYSA-N
    InChI: InChI=1S/C16H16N2O3/c19-15(17-10-9-12-5-2-1-3-6-12)13-7-4-8-14(11-13)16(20)18-21/h1-8,11,21H,9-10H2,(H,17,19)(H,18,20)
  11. STX64
      规格或纯度 :
    • ≥98%
    CAS号 : 288628-05-7        Compound CID : 5287541
    分子式: C14H15NO5S        分子量: 309.34
    IUPAC Name: (6-oxo-8,9,10,11-tetrahydro-7H-cyclohepta[c]chromen-3-yl) sulfamate
    SMILES: C1CCC2=C(CC1)C(=O)OC3=C2C=CC(=C3)OS(=O)(=O)N
    InChIKey: DSLPMJSGSBLWRE-UHFFFAOYSA-N
    InChI: InChI=1S/C14H15NO5S/c15-21(17,18)20-9-6-7-11-10-4-2-1-3-5-12(10)14(16)19-13(11)8-9/h6-8H,1-5H2,(H2,15,17,18)
  12. 1-萘乙酰精胺
      规格或纯度 :
    • ≥96%
    CAS号 : 122306-11-0       
    分子式: C22H34N4O        分子量: 370.53
    IUPAC Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-naphthalen-1-ylacetamide
    SMILES: C1=CC=C2C(=C1)C=CC=C2CC(=O)NCCCNCCCCNCCCN
    InChIKey: ZUINPPQIQARTKX-UHFFFAOYSA-N
    InChI: InChI=1S/C22H34N4O/c23-12-6-15-24-13-3-4-14-25-16-7-17-26-22(27)18-20-10-5-9-19-8-1-2-11-21(19)20/h1-2,5,8-11,24-25H,3-4,6-7,12-18,23H2,(H,26,27)
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