Metabolites

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  1. Retinol, Agonist of Testicular receptor 4
    Cas#: 68-26-8        Compound CID:  445354
    Formula:  C20H30O        Molecular Weight: 286.45
    IUPAC Name: (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraen-1-ol
    SMILES: CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CCO)C)C
    InChIKey: FPIPGXGPPPQFEQ-OVSJKPMPSA-N
    InChI: InChI=1S/C20H30O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,21H,7,10,14-15H2,1-5H3/b9-6+,12-11+,16-8+,17-13+
    Synonyms: Chocola A | Vitamin A (Natural) | Vitamin A1, all-trans- | Vitpex | 2,4,6,8-Nonatetraen-1-ol, 3,7-dimethyl-9-(2,6,6-t...
  2. Tetrahydrobiopterin, Activator of L-Phenylalanine hydroxylase
    Cas#: 17528-72-2        Compound CID:  135402045
    Formula:  C9H15N5O3        Molecular Weight: 241.25
    IUPAC Name: 2-amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydro-3H-pteridin-4-one
    SMILES: CC(C(C1CNC2=C(N1)C(=O)NC(=N2)N)O)O
    InChIKey: FNKQXYHWGSIFBK-UHFFFAOYSA-N
    InChI: InChI=1S/C9H15N5O3/c1-3(15)6(16)4-2-11-7-5(12-4)8(17)14-9(10)13-7/h3-4,6,12,15-16H,2H2,1H3,(H4,10,11,13,14,17)
    Synonyms: tetrahydrobiopterin | HY-107383 | 1-(2-amino-4-hydroxy-5,6,7,8-tetrahydropteridin-6-yl)propane-1,2-diol | 5-26-18-004...
  3. α-Methyl-DL-phenylalanine, Inhibitor of L-Phenylalanine hydroxylase
    Cas#: 1132-26-9        Compound CID:  108055
    Formula:  C10H13NO2        Molecular Weight: 179.22
    IUPAC Name: 2-amino-2-methyl-3-phenylpropanoic acid
    SMILES: CC(CC1=CC=CC=C1)(C(=O)O)N
    InChIKey: HYOWVAAEQCNGLE-UHFFFAOYSA-N
    InChI: InChI=1S/C10H13NO2/c1-10(11,9(12)13)7-8-5-3-2-4-6-8/h2-6H,7,11H2,1H3,(H,12,13)
    Synonyms: alpha-Methyl-DL-phenylalanine|1132-26-9|2-amino-2-methyl-3-phenylpropanoic acid|2-Amino-2-methyl-3-phenylpropionic ac...
  4. Retinol, Agonist of Testicular receptor 4
    Cas#: 68-26-8        Compound CID:  445354
    Formula:  C20H30O        Molecular Weight: 286.45
    IUPAC Name: (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraen-1-ol
    SMILES: CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CCO)C)C
    InChIKey: FPIPGXGPPPQFEQ-OVSJKPMPSA-N
    InChI: InChI=1S/C20H30O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,21H,7,10,14-15H2,1-5H3/b9-6+,12-11+,16-8+,17-13+
    Synonyms: retinol|Vitamin A|all-trans-Retinol|68-26-8|Vitamin A1|Alphalin|Chocola A|Alphasterol|Apostavit|Aquasynth|Axerophthol...
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