Metabolites

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  1. Diethylstilbestrol, Agonist of Estrogen receptor-α;Agonist of Estrogen receptor-β;Antagonist of Estrogen-related receptor-α;Antagonist of Estrogen-related receptor-β;Antagonist of Estrogen-related receptor-γ
    Cas#: 56-53-1        Compound CID:  448537
    Formula:  C18H20O2        Molecular Weight: 268.35
    IUPAC Name: 4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol
    SMILES: CCC(=C(CC)C1=CC=C(C=C1)O)C2=CC=C(C=C2)O
    InChIKey: RGLYKWWBQGJZGM-ISLYRVAYSA-N
    InChI: InChI=1S/C18H20O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,19-20H,3-4H2,1-2H3/b18-17+
    Synonyms: DES | 4-[(3E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol | Diethylstilbesterol | Makarol | Stilbofolin | 4,4'-(Hex-3-ene...
  2. (S)-(-)-2-Amino-4-pentenoic acid, Inhibitor of Glutamic acid decarboxylase 1;Inhibitor of Glutamic acid decarboxylase 2
    Cas#: 16338-48-0        Compound CID:  167529
    Formula:  C5H9NO2        Molecular Weight: 115.13
    IUPAC Name: (2S)-2-aminopent-4-enoic acid
    SMILES: C=CCC(C(=O)O)N
    InChIKey: WNNNWFKQCKFSDK-BYPYZUCNSA-N
    InChI: InChI=1S/C5H9NO2/c1-2-3-4(6)5(7)8/h2,4H,1,3,6H2,(H,7,8)/t4-/m0/s1
    Synonyms: (S)-2-aminopent-4-enoic acid;3-VINYL-L-ALANINE | A3625 | HMS3260M04 | (-)-Allylglycine | A inverted exclamation mark-...
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