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  1. 二丙酸倍氯米松
    CAS号 : 5534-09-8        Compound CID : 21700
    分子式: C28H37ClO7        分子量: 521.04
    IUPAC Name: [2-[(8S,9R,10S,11S,13S,14S,16S,17R)-9-chloro-11-hydroxy-10,13,16-trimethyl-3-oxo-17-propanoyloxy-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate
    SMILES: CCC(=O)OCC(=O)C1(C(CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)Cl)O)C)C)OC(=O)CC
    InChIKey: KUVIULQEHSCUHY-XYWKZLDCSA-N
    InChI: InChI=1S/C28H37ClO7/c1-6-23(33)35-15-22(32)28(36-24(34)7-2)16(3)12-20-19-9-8-17-13-18(30)10-11-25(17,4)27(19,29)21(31)14-26(20,28)5/h10-11,13,16,19-21,31H,6-9,12,14-15H2,1-5H3/t16-,19-,20-,21-,25-,26-,27-,28-/m0/s1
  2. YM-58483 (BTP2)
    CAS号 : 223499-30-7        Compound CID : 2455
    分子式: C15H9F6N5OS        分子量: 421.32
    IUPAC Name: N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]-4-methylthiadiazole-5-carboxamide
    SMILES: CC1=C(SN=N1)C(=O)NC2=CC=C(C=C2)N3C(=CC(=N3)C(F)(F)F)C(F)(F)F
    InChIKey: XPRZIORDEVHURQ-UHFFFAOYSA-N
    InChI: InChI=1S/C15H9F6N5OS/c1-7-12(28-25-23-7)13(27)22-8-2-4-9(5-3-8)26-11(15(19,20)21)6-10(24-26)14(16,17)18/h2-6H,1H3,(H,22,27)
  3. 甲氯芬那酸
    CAS号 : 644-62-2        Compound CID : 4037
    分子式: C14H11Cl2NO2        分子量: 296.15
    IUPAC Name: 2-(2,6-dichloro-3-methylanilino)benzoic acid
    SMILES: CC1=C(C(=C(C=C1)Cl)NC2=CC=CC=C2C(=O)O)Cl
    InChIKey: SBDNJUWAMKYJOX-UHFFFAOYSA-N
    InChI: InChI=1S/C14H11Cl2NO2/c1-8-6-7-10(15)13(12(8)16)17-11-5-3-2-4-9(11)14(18)19/h2-7,17H,1H3,(H,18,19)
  4. 氟灭酸
    CAS号 : 530-78-9        Compound CID : 3371
    分子式: C14H10F3NO2        分子量: 281.23
    IUPAC Name: 2-[3-(trifluoromethyl)anilino]benzoic acid
    SMILES: C1=CC=C(C(=C1)C(=O)O)NC2=CC=CC(=C2)C(F)(F)F
    InChIKey: LPEPZBJOKDYZAD-UHFFFAOYSA-N
    InChI: InChI=1S/C14H10F3NO2/c15-14(16,17)9-4-3-5-10(8-9)18-12-7-2-1-6-11(12)13(19)20/h1-8,18H,(H,19,20)
  5. YM-58483 (BTP2)
    CAS号 : 223499-30-7        Compound CID : 2455
    分子式: C15H9F6N5OS        分子量: 421.32
    IUPAC Name: N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]-4-methylthiadiazole-5-carboxamide
    SMILES: CC1=C(SN=N1)C(=O)NC2=CC=C(C=C2)N3C(=CC(=N3)C(F)(F)F)C(F)(F)F
    InChIKey: XPRZIORDEVHURQ-UHFFFAOYSA-N
    InChI: InChI=1S/C15H9F6N5OS/c1-7-12(28-25-23-7)13(27)22-8-2-4-9(5-3-8)26-11(15(19,20)21)6-10(24-26)14(16,17)18/h2-6H,1H3,(H,22,27)
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