小分子和化合物库

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显示第112个,产品总数39

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  1. 尿苷-5′-二磷酸二钠盐水合物
      规格或纯度 :
    • ≥96%(HPLC)
    CAS号 : 27821-45-0        Compound CID : 11957711
    分子式: C9H12N2Na2O12P2·xH2O        分子量: 448.12 (anhydrous basis)
    IUPAC Name: disodium;[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] hydrogen phosphate
    SMILES: C1=CN(C(=O)NC1=O)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)[O-])O)O.[Na+].[Na+]
    InChIKey: ZQKVPFKBNNAXCE-WFIJOQBCSA-L
    InChI: InChI=1S/C9H14N2O12P2.2Na/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18;;/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18);;/q;2*+1/p-2/t4-,6-,7-,8-;;/m1../s1
  2. 7-乙基喜树碱
      规格或纯度 :
    • ≥96%(HPLC)
    CAS号 : 78287-27-1        Compound CID : 127584
    分子式: C22H20N2O4        分子量: 376.41
    IUPAC Name: (19S)-10,19-diethyl-19-hydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione
    SMILES: CCC1=C2CN3C(=CC4=C(C3=O)COC(=O)C4(CC)O)C2=NC5=CC=CC=C51
    InChIKey: MYQKIWCVEPUPIL-QFIPXVFZSA-N
    InChI: InChI=1S/C22H20N2O4/c1-3-12-13-7-5-6-8-17(13)23-19-14(12)10-24-18(19)9-16-15(20(24)25)11-28-21(26)22(16,27)4-2/h5-9,27H,3-4,10-11H2,1-2H3/t22-/m0/s1
  3. 壳六糖
      规格或纯度 :
    • ≥96%(HPLC)
    CAS号 : 41708-95-6        Compound CID : 92132215
    分子式: C36H68N6O25·6HCl        分子量: 1203.71
    IUPAC Name: (2R,3S,4R,5R,6S)-5-amino-6-[(2R,3S,4R,5R,6S)-5-amino-6-[(2R,3S,4R,5R,6S)-5-amino-6-[(2R,3S,4R,5R,6S)-5-amino-6-[(2R,3S,4R,5R,6S)-5-amino-6-[(2R,3S,4R,5R)-5-amino-4,6-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-2-(hydroxymethyl)oxane-3,4-diol;hexahydrochloride
    SMILES: C(C1C(C(C(C(O1)OC2C(OC(C(C2O)N)OC3C(OC(C(C3O)N)OC4C(OC(C(C4O)N)OC5C(OC(C(C5O)N)OC6C(OC(C(C6O)N)O)CO)CO)CO)CO)CO)N)O)O)O.Cl.Cl.Cl.Cl.Cl.Cl
    InChIKey: VWRFWLUKCKULCO-JARJSWFESA-N
    InChI: InChI=1S/C36H68N6O25.6ClH/c37-13-21(51)26(8(2-44)57-31(13)56)63-33-15(39)23(53)28(10(4-46)59-33)65-35-17(41)25(55)30(12(6-48)61-35)67-36-18(42)24(54)29(11(5-47)62-36)66-34-16(40)22(52)27(9(3-45)60-34)64-32-14(38)20(50)19(49)7(1-43)58-32;;;;;;/h7-36,43-56H,1-6,37-42H2;6*1H/t7-,8-,9-,10-,11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31?,32+,33+,34+,35+,36+;;;;;;/m1....../s1
  4. 紫草素
      规格或纯度 :
    • ≥96%(HPLC)
    CAS号 : 517-88-4        Compound CID : 72521
    分子式: C16H16O5        分子量: 288.3
    IUPAC Name: 5,8-dihydroxy-2-[(1S)-1-hydroxy-4-methylpent-3-enyl]naphthalene-1,4-dione
    SMILES: CC(=CCC(C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)O)C
    InChIKey: NEZONWMXZKDMKF-JTQLQIEISA-N
    InChI: InChI=1S/C16H16O5/c1-8(2)3-4-10(17)9-7-13(20)14-11(18)5-6-12(19)15(14)16(9)21/h3,5-7,10,17-19H,4H2,1-2H3/t10-/m0/s1
  5. (R)-3,4-DCPG,AMPA拮抗剂/弱NMDA拮抗剂
      规格或纯度 :
    • ≥96%(HPLC)
    CAS号 : 201730-10-1       
    分子式: C10H9NO6        分子量: 239.18
    IUPAC Name: 4-[(R)-amino(carboxy)methyl]phthalic acid
    SMILES: C1=CC(=C(C=C1C(C(=O)O)N)C(=O)O)C(=O)O
    InChIKey: IJVMOGKBEVRBPP-SSDOTTSWSA-N
    InChI: InChI=1S/C10H9NO6/c11-7(10(16)17)4-1-2-5(8(12)13)6(3-4)9(14)15/h1-3,7H,11H2,(H,12,13)(H,14,15)(H,16,17)/t7-/m1/s1
  6. MRS 2500 四铵盐
      规格或纯度 :
    • ≥96%(HPLC)
    CAS号 : 630103-23-0        Compound CID : 90488745
    分子式: C13H18N5O8P2I•4NH3        分子量: 629.29
    IUPAC Name: azane;[(1R,2S,4S,5S)-4-[2-iodo-6-(methylamino)purin-9-yl]-2-phosphonooxy-1-bicyclo[3.1.0]hexanyl]methyl dihydrogen phosphate
    SMILES: CNC1=C2C(=NC(=N1)I)N(C=N2)C3CC(C4(C3C4)COP(=O)(O)O)OP(=O)(O)O.N.N.N.N
    InChIKey: FVTFHHDVLNQSME-AVAGOIHISA-N
    InChI: InChI=1S/C13H18IN5O8P2.4H3N/c1-15-10-9-11(18-12(14)17-10)19(5-16-9)7-2-8(27-29(23,24)25)13(3-6(7)13)4-26-28(20,21)22;;;;/h5-8H,2-4H2,1H3,(H,15,17,18)(H2,20,21,22)(H2,23,24,25);4*1H3/t6-,7+,8+,13+;;;;/m1..../s1
  7. KYT 0353,L型氨基酸转运蛋白1(LAT1)抑制剂
      规格或纯度 :
    • ≥96%(HPLC)
    CAS号 : 1597402-27-1        Compound CID : 122553374
    分子式: C23H21Cl4N3O4        分子量: 545.24
    IUPAC Name: (2S)-2-amino-3-[4-[(5-amino-2-phenyl-1,3-benzoxazol-7-yl)methoxy]-3,5-dichlorophenyl]propanoic acid;dihydrochloride
    SMILES: C1=CC=C(C=C1)C2=NC3=CC(=CC(=C3O2)COC4=C(C=C(C=C4Cl)CC(C(=O)O)N)Cl)N.Cl.Cl
    InChIKey: MJSAOPNUSNNYQL-NTEVMMBTSA-N
    InChI: InChI=1S/C23H19Cl2N3O4.2ClH/c24-16-6-12(8-18(27)23(29)30)7-17(25)21(16)31-11-14-9-15(26)10-19-20(14)32-22(28-19)13-4-2-1-3-5-13;;/h1-7,9-10,18H,8,11,26-27H2,(H,29,30);2*1H/t18-;;/m0../s1
  8. GNTI二盐酸盐
      规格或纯度 :
    • ≥96%(HPLC)
    CAS号 : 351183-88-5        Compound CID : 90479777
    分子式: C₂₇H₂₉N₅O₃•₂HCl        分子量: 544.48
    SMILES: OC3=CC=C2CC([C@@]5(O)[C@@]4(CC8)C2=C3O[C@H]4C(NC7=C6C=C(NC=N)C=C7)=C6C5)N8CC1CC1.Cl.Cl
    InChIKey: GJPIMNXJPMPQHK-CVVXFVLRSA-N
  9. CGP 54626 盐酸盐
      规格或纯度 :
    • ≥96%(HPLC)
    CAS号 : 149184-21-4        Compound CID : 197583
    分子式: C18H28Cl2NO3P•HCl        分子量: 444.76
    IUPAC Name: cyclohexylmethyl-[(2S)-3-[[(1S)-1-(3,4-dichlorophenyl)ethyl]amino]-2-hydroxypropyl]phosphinic acid;hydrochloride
    SMILES: CC(C1=CC(=C(C=C1)Cl)Cl)NCC(CP(=O)(CC2CCCCC2)O)O.Cl
    InChIKey: ZQCFHOVIXCJPLE-LINSIKMZSA-N
    InChI: InChI=1S/C18H28Cl2NO3P.ClH/c1-13(15-7-8-17(19)18(20)9-15)21-10-16(22)12-25(23,24)11-14-5-3-2-4-6-14;/h7-9,13-14,16,21-22H,2-6,10-12H2,1H3,(H,23,24);1H/t13-,16-;/m0./s1
  10. CGP 20712 二盐酸盐
      规格或纯度 :
    • ≥96%(HPLC)
    CAS号 : 1216905-73-5        Compound CID : 56972164
    分子式: C23H25F3N4O5•2HCl        分子量: 567.39
    IUPAC Name: 2-hydroxy-5-[2-[[2-hydroxy-3-[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenoxy]propyl]amino]ethoxy]benzamide;dihydrochloride
    SMILES: CN1C=C(N=C1C2=CC=C(C=C2)OCC(CNCCOC3=CC(=C(C=C3)O)C(=O)N)O)C(F)(F)F.Cl.Cl
    InChIKey: PURFQCFKYNMIQF-UHFFFAOYSA-N
    InChI: InChI=1S/C23H25F3N4O5.2ClH/c1-30-12-20(23(24,25)26)29-22(30)14-2-4-16(5-3-14)35-13-15(31)11-28-8-9-34-17-6-7-19(32)18(10-17)21(27)33;;/h2-7,10,12,15,28,31-32H,8-9,11,13H2,1H3,(H2,27,33);2*1H
  11. Cercosporamide,Mnk2抑制剂
      规格或纯度 :
    • ≥96%(HPLC)
    CAS号 : 131436-22-1        Compound CID : 131379
    分子式: C16H13NO7        分子量: 331.28
    IUPAC Name: (9aS)-8-acetyl-1,3,7-trihydroxy-9a-methyl-9-oxodibenzofuran-4-carboxamide
    SMILES: CC(=O)C1=C(C=C2C(C1=O)(C3=C(C=C(C(=C3O2)C(=O)N)O)O)C)O
    InChIKey: GEWLYFZWVLXQME-MRXNPFEDSA-N
    InChI: InChI=1S/C16H13NO7/c1-5(18)10-7(20)4-9-16(2,14(10)22)12-8(21)3-6(19)11(15(17)23)13(12)24-9/h3-4,19-21H,1-2H3,(H2,17,23)/t16-/m1/s1
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