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  1. Valspodar, P-glycoprotein 1 inhibitor
    Cas Number: 121584-18-7        Compound CID:  5281884
    Formula:  C63H111N11O12        Molecular Weight: 1214.62
    IUPAC Name:  (3S,6S,9S,12R,15S,18S,21S,24S,30S,33S)-1,4,7,10,12,15,19,25,28-nonamethyl-33-[(E,2R)-2-methylhex-4-enoyl]-6,9,18,24-tetrakis(2-methylpropyl)-3,21,30-tshow more
    SMILES:  CC=CCC(C)C(=O)C1C(=O)NC(C(=O)N(CC(=O)N(C(C(=O)NC(C(=O)N(C(C(=O)NC(C(=O)NC(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N1C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)CC(C)C)C)Cshow more
    InChIKey: YJDYDFNKCBANTM-QCWCSKBGSA-N
    InChI:  InChI=1S/C63H111N11O12/c1-26-27-28-41(16)53(76)52-57(80)67-49(38(10)11)61(84)68(19)33-48(75)69(20)44(29-34(2)3)56(79)66-50(39(12)13)62(85)70(21)45(30-show more
    Synonyms: Sdz-psc-833 | SDZ PSC833 | Valspodar; (PSC-833 | SCHEMBL21751941 | Cyclosporin A, 6-[(2S,4R,6E)-4-methyl-2-(methylami...
  2. Aripiprazole, Serotonin 2a (5-HT2a) receptor antagonist
    Cas Number: 129722-12-9
    Formula:  C23H27Cl2N3O2        Molecular Weight: 448.39
    IUPAC Name:  7-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one
    SMILES:  C1CC(=O)NC2=C1C=CC(=C2)OCCCCN3CCN(CC3)C4=C(C(=CC=C4)Cl)Cl
    InChIKey: CEUORZQYGODEFX-UHFFFAOYSA-N
    InChI:  InChI=1S/C23H27Cl2N3O2/c24-19-4-3-5-21(23(19)25)28-13-11-27(12-14-28)10-1-2-15-30-18-8-6-17-7-9-22(29)26-20(17)16-18/h3-6,8,16H,1-2,7,9-15H2,(H,26,29)
    Synonyms: 7-[4-[4-(2,3-Dichlorophenyl)-1-piperazinyl]butoxy]-3,4-dihydrocarbostyril | Aripiprazole [USAN:INN:BAN] | Aripiprazol...
  3. α-Ketoglutaric acid, Agonist of oxoglutarate receptor
    Cas Number: 328-50-7        EC Number: 206-330-3
    Formula:  C5H6O5        Molecular Weight: 146.1
    IUPAC Name:  2-oxopentanedioic acid
    SMILES:  C(CC(=O)O)C(=O)C(=O)O
    InChIKey: KPGXRSRHYNQIFN-UHFFFAOYSA-N
    InChI:  InChI=1S/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10)
    Synonyms: Pentanedioic acid, oxo- | 2-ketoglutaric acid | 4qkd | ALFA-KETOGLUTARIC ACID | keto glutaric acid | 2-ketoglutarate ...
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