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. L-Histidine, Peptide transporter 3;Peptide transporter 4;Sodium-coupled neutral amino acid transporter 5
    Cas#: 71-00-1        Compound CID:  6274
    Formula:  C6H9N3O2        Molecular Weight: 155.15
    IUPAC Name: (2S)-2-amino-3-(1H-imidazol-5-yl)propanoic acid
    SMILES: C1=C(NC=N1)CC(C(=O)O)N
    InChIKey: HNDVDQJCIGZPNO-YFKPBYRVSA-N
    InChI: InChI=1S/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H,8,9)(H,10,11)/t5-/m0/s1
    Synonyms: (S)-2-Amino-3-(4-imidazolyl)propionic acid | glyoxaline-5-alanine | NSC 137773 | L-2-Amino-3-(4-imidazolyl)propionic ...
  3. L-Histidine, Activator of carbonic anhydrase 1;Activator of carbonic anhydrase 14;Activator of carbonic anhydrase 5A;Activator of carbonic anhydrase 7
    Cas#: 71-00-1        Compound CID:  6274
    Formula:  C6H9N3O2        Molecular Weight: 155.15
    IUPAC Name: (2S)-2-amino-3-(1H-imidazol-5-yl)propanoic acid
    SMILES: C1=C(NC=N1)CC(C(=O)O)N
    InChIKey: HNDVDQJCIGZPNO-YFKPBYRVSA-N
    InChI: InChI=1S/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H,8,9)(H,10,11)/t5-/m0/s1
    Synonyms: His | NSC 137773 | [3H]histidine | [3H]-histidine | amino-4-imidazoleproprionic acid | BDBM181118 | L-Histidin | L-be...
  4. L-Histidine, Peptide transporter 3;Peptide transporter 4;Sodium-coupled neutral amino acid transporter 5
    Cas#: 71-00-1        Compound CID:  6274
    Formula:  C6H9N3O2        Molecular Weight: 155.15
    IUPAC Name: (2S)-2-amino-3-(1H-imidazol-5-yl)propanoic acid
    SMILES: C1=C(NC=N1)CC(C(=O)O)N
    InChIKey: HNDVDQJCIGZPNO-YFKPBYRVSA-N
    InChI: InChI=1S/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H,8,9)(H,10,11)/t5-/m0/s1
    Synonyms: L-histidine|histidine|71-00-1|H-His-OH|glyoxaline-5-alanine|Anti-rheuma|L-(-)-Histidine|Istidina|S-Histidine|(L)-Hist...
  5. L-O-Phosphoserine, Agonist of mGlu 4 receptor;Agonist of mGlu 6 receptor;Agonist of mGlu 7 receptor;Agonist of mGlu 8 receptor
    Cas#: 407-41-0        Compound CID:  68841
    Formula:  C3H8NO6P        Molecular Weight: 185.07
    IUPAC Name: (2S)-2-amino-3-phosphonooxypropanoic acid
    SMILES: C(C(C(=O)O)N)OP(=O)(O)O
    InChIKey: BZQFBWGGLXLEPQ-REOHCLBHSA-N
    InChI: InChI=1S/C3H8NO6P/c4-2(3(5)6)1-10-11(7,8)9/h2H,1,4H2,(H,5,6)(H2,7,8,9)/t2-/m0/s1
    Synonyms: O-phospho-L-serine|Dexfosfoserine|407-41-0|phosphoserine|L-O-Phosphoserine|Fosforina|L-SOP|O-Phosphoserine|L-Phosphos...
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