小分子和化合物库

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显示第112个,产品总数116

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  1. 双氢麦角胺甲磺酸盐
    CAS号 : 6190-39-2        Compound CID : 71171
    分子式: C33H37N5O5·CH4O3S        分子量: 679.79
    IUPAC Name: (6aR,9R,10aR)-N-[(1S,2S,4R,7S)-7-benzyl-2-hydroxy-4-methyl-5,8-dioxo-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl]-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;methanesulfonic acid
    SMILES: CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CC6C(CC7=CNC8=CC=CC6=C78)N(C5)C.CS(=O)(=O)O
    InChIKey: ADYPXRFPBQGGAH-UMYZUSPBSA-N
    InChI: InChI=1S/C33H37N5O5.CH4O3S/c1-32(35-29(39)21-15-23-22-10-6-11-24-28(22)20(17-34-24)16-25(23)36(2)18-21)31(41)38-26(14-19-8-4-3-5-9-19)30(40)37-13-7-12-27(37)33(38,42)43-32;1-5(2,3)4/h3-6,8-11,17,21,23,25-27,34,42H,7,12-16,18H2,1-2H3,(H,35,39);1H3,(H,2,3,4)/t21-,23-,25-,26+,27+,32-,33+;/m1./s1
  2. 5-羟基色胺
    CAS号 : 50-67-9        Compound CID : 5202
    分子式: C10H12N2O        分子量: 176.22
    IUPAC Name: 3-(2-aminoethyl)-1H-indol-5-ol
    SMILES: C1=CC2=C(C=C1O)C(=CN2)CCN
    InChIKey: QZAYGJVTTNCVMB-UHFFFAOYSA-N
    InChI: InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2
  3. GR 46611,5-HT 1B / 1D激动剂
      规格或纯度 :
    • ≥97%
    CAS号 : 185259-85-2        Compound CID : 6160690
    分子式: C23H27N3O2        分子量: 377.49
    IUPAC Name: (E)-3-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]-N-[(4-methoxyphenyl)methyl]prop-2-enamide
    SMILES: CN(C)CCC1=CNC2=C1C=C(C=C2)C=CC(=O)NCC3=CC=C(C=C3)OC
    InChIKey: LBVZWEWTNUDWNS-YRNVUSSQSA-N
    InChI: InChI=1S/C23H27N3O2/c1-26(2)13-12-19-16-24-22-10-6-17(14-21(19)22)7-11-23(27)25-15-18-4-8-20(28-3)9-5-18/h4-11,14,16,24H,12-13,15H2,1-3H3,(H,25,27)/b11-7+
  4. PNU 142633,5-HT1激动剂
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号 : 187665-65-2        Compound CID : 9845148
    分子式: C24H30N4O3        分子量: 422.53
    IUPAC Name: (1S)-1-[2-[4-(4-carbamoylphenyl)piperazin-1-yl]ethyl]-N-methyl-3,4-dihydro-1H-isochromene-6-carboxamide
    SMILES: CNC(=O)C1=CC2=C(C=C1)C(OCC2)CCN3CCN(CC3)C4=CC=C(C=C4)C(=O)N
    InChIKey: PNTVCCRNJOGKGA-QFIPXVFZSA-N
    InChI: InChI=1S/C24H30N4O3/c1-26-24(30)19-4-7-21-18(16-19)9-15-31-22(21)8-10-27-11-13-28(14-12-27)20-5-2-17(3-6-20)23(25)29/h2-7,16,22H,8-15H2,1H3,(H2,25,29)(H,26,30)/t22-/m0/s1
  5. 毒黄素
      规格或纯度 :
    • ≥98%
    CAS号 : 84-82-2        Compound CID : 66541
    分子式: C7H7N5O2        分子量: 193.16
    IUPAC Name: 1,6-dimethylpyrimido[5,4-e][1,2,4]triazine-5,7-dione
    SMILES: CN1C2=NC(=O)N(C(=O)C2=NC=N1)C
    InChIKey: SLGRAIAQIAUZAQ-UHFFFAOYSA-N
    InChI: InChI=1S/C7H7N5O2/c1-11-6(13)4-5(10-7(11)14)12(2)9-3-8-4/h3H,1-2H3
  6. Inauhzin
      规格或纯度 :
    • ≥96%
    CAS号 : 309271-94-1        Compound CID : 5494506
    分子式: C25H19N5OS2        分子量: 469.58
    IUPAC Name: 1-phenothiazin-10-yl-2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)butan-1-one
    SMILES: CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)SC4=NC5=C(C6=CC=CC=C6N5)N=N4
    InChIKey: VHUOXERIKQWIJE-UHFFFAOYSA-N
    InChI: InChI=1S/C25H19N5OS2/c1-2-19(33-25-27-23-22(28-29-25)15-9-3-4-10-16(15)26-23)24(31)30-17-11-5-7-13-20(17)32-21-14-8-6-12-18(21)30/h3-14,19H,2H2,1H3,(H,26,27,29)
  7. SRT2183
      规格或纯度 :
    • ≥99%
    CAS号 : 1001908-89-9        Compound CID : 24180126
    分子式: C27H24N4O2S        分子量: 468.57
    IUPAC Name: N-[2-[3-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]phenyl]naphthalene-2-carboxamide
    SMILES: C1CN(CC1O)CC2=CSC3=NC(=CN23)C4=CC=CC=C4NC(=O)C5=CC6=CC=CC=C6C=C5
    InChIKey: MUFSINOSQBMSLE-JOCHJYFZSA-N
    InChI: InChI=1S/C27H24N4O2S/c32-22-11-12-30(15-22)14-21-17-34-27-29-25(16-31(21)27)23-7-3-4-8-24(23)28-26(33)20-10-9-18-5-1-2-6-19(18)13-20/h1-10,13,16-17,22,32H,11-12,14-15H2,(H,28,33)/t22-/m1/s1
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