Metabolites

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  1. 5α-Androst-16-en-3α-ol, Antagonist of Constitutive androstane receptor
    Cas#: 1153-51-1        Compound CID:  101989
    Formula:  C19H30O        Molecular Weight: 274.44
    IUPAC Name: (3R,5S,8R,9S,10S,13R,14S)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
    SMILES: CC12CCC3C(C1CC=C2)CCC4C3(CCC(C4)O)C
    InChIKey: KRVXMNNRSSQZJP-PHFHYRSDSA-N
    InChI: InChI=1S/C19H30O/c1-18-9-3-4-16(18)15-6-5-13-12-14(20)7-11-19(13,2)17(15)8-10-18/h3,9,13-17,20H,4-8,10-12H2,1-2H3/t13-,14+,15-,16-,17-,18-,19-/m0/s1
    Synonyms: (3a,5a)-Androst-16-en-3-ol | AKOS022350563 | 5 | Pitrex cream | D06200 | 3.alpha.-Hydroxyandrost-16-ene | A-ol | (3R,...
  2. arachidonyl-2-chloroethylamide, Agonist of CB 1 receptor
    IUPAC Name: (5Z,8Z,11Z,14Z)-N-(2-chloroethyl)icosa-5,8,11,14-tetraenamide
    SMILES: CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCCl
    InChIKey: SCJNCDSAIRBRIA-DOFZRALJSA-N
    InChI: InChI=1S/C22H36ClNO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)24-21-20-23/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-21H2,1H3,(H,24,25)/b7-6-,10-9-,13-12-,16-15-
    Synonyms: SR-01000946682 | GLXC-27067 | HMS3649N11 | AKOS024456526 | GTPL738 | (5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid ...
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