Metabolites
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L-Tryptophan, Allosteric modulator of CaS receptor;Agonist of GPR139;Inhibitor of Proton-coupled Amino acid Transporter 1Cas#: 73-22-3 Compound CID: 6305Formula: C11H12N2O2 Molecular Weight: 204.23IUPAC Name: (2S)-2-amino-3-(1H-indol-3-yl)propanoic acidSMILES: C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NInChIKey: QIVBCDIJIAJPQS-VIFPVBQESA-NInChI: InChI=1S/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1Synonyms: (S)-2-Amino-3-(3-indolyl)propionic acid | h-Trp-oh | L-Trytophan
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Ethinyl Estradiol, Estrogen receptor alpha agonistCas#: 57-63-6 Compound CID: 5991Formula: C20H24O2 Molecular Weight: 296.4IUPAC Name: (8R,9S,13S,14S,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diolSMILES: CC12CCC3C(C1CCC2(C#C)O)CCC4=C3C=CC(=C4)OInChIKey: BFPYWIDHMRZLRN-SLHNCBLASA-NInChI: InChI=1S/C20H24O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,5,7,12,16-18,21-22H,4,6,8-11H2,2H3/t16-,17-,18+,19+,20+/m1/s1Synonyms: Ethinylestradiol (Standard) | Ethynyloestradiol | Estigyn | 17-Ethinylestradiol | CHEBI:4903 | Ethinyl Estradiol [USP...
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5-Hydroxytryptamine, Agonist of 5-HT 1A receptor;Agonist of 5-HT 1B receptor;Agonist of 5-HT 1D receptor;Agonist of 5-ht 1e receptor;Agonist of 5-HT 1F receptor;Agonist of 5-HT 2A receptor;Agonist of 5-HT 2B receptor;Agonist of 5-HT 2C receptor;Agonist of 5-HT 3A;Agonist of 5Cas#: 50-67-9 Compound CID: 5202Formula: C10H12N2O Molecular Weight: 176.22IUPAC Name: 3-(2-aminoethyl)-1H-indol-5-olSMILES: C1=CC2=C(C=C1O)C(=CN2)CCNInChIKey: QZAYGJVTTNCVMB-UHFFFAOYSA-NInChI: InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2Synonyms: 5-HT | 3-(b-Aminoethyl)-5-hydroxyindole | 5 Hydroxytryptamine | Serotonine | 3-(.beta.-Aminoethyl)-5-hydroxyindole | ...
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L(+)-Glutamic acidCas#: 56-86-0 Compound CID: 33032Formula: C5H9NO4 Molecular Weight: 147.13IUPAC Name: (2S)-2-aminopentanedioic acidSMILES: C(CC(=O)O)C(C(=O)O)NInChIKey: WHUUTDBJXJRKMK-VKHMYHEASA-NInChI: InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1Synonyms: DTXCID30659 | glt | 1ii5 | Glutamate, L- | Glutamic acid, (S)- | Glutaton | glutamate | L-Glutaminic acid | Gamma-L-G...
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L(+)-Glutamic acidCas#: 56-86-0 Compound CID: 33032Formula: C5H9NO4 Molecular Weight: 147.13IUPAC Name: (2S)-2-aminopentanedioic acidSMILES: C(CC(=O)O)C(C(=O)O)NInChIKey: WHUUTDBJXJRKMK-VKHMYHEASA-NInChI: InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1Synonyms: DTXCID30659 | glt | 1ii5 | Glutamate, L- | Glutamic acid, (S)- | Glutaton | glutamate | L-Glutaminic acid | Gamma-L-G...
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5-OxoETE, Agonist of OXE receptorCas#: 106154-18-1 Compound CID: 5283159Formula: C20H30O3 Molecular Weight: 318.45IUPAC Name: (6E,8Z,11Z,14Z)-5-oxoicosa-6,8,11,14-tetraenoic acidSMILES: CCCCCC=CCC=CCC=CC=CC(=O)CCCC(=O)OInChIKey: MEASLHGILYBXFO-XTDASVJISA-NInChI: InChI=1S/C20H30O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19(21)17-15-18-20(22)23/h6-7,9-10,12-14,16H,2-5,8,11,15,17-18H2,1H3,(H,22,23)/b7-6-,10-9-,13-12-,16-14+Synonyms: HMS1361I15 | SR-01000946916 | 5-oxo-6,8,11,14-eicosatetraenoate | CHEBI:52449 | 5-Keto-6,8,11,14-eicosatetraenoic aci...
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5(S)-HPETE, Agonist of OXE receptor;Activator of TRPV1Cas#: 71774-08-8 Compound CID: 5280778Formula: C20H32O4 Molecular Weight: 336.47IUPAC Name: (5S,6E,8Z,11Z,14Z)-5-hydroperoxyicosa-6,8,11,14-tetraenoic acidSMILES: CCCCCC=CCC=CCC=CC=CC(CCCC(=O)O)OOInChIKey: JNUUNUQHXIOFDA-JGKLHWIESA-NInChI: InChI=1S/C20H32O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19(24-23)17-15-18-20(21)22/h6-7,9-10,12-14,16,19,23H,2-5,8,11,15,17-18H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-,16-14+/t19-/m1/s1Synonyms: 5(S)-hydroxyperoxy-6E,8Z,11Z,14Z-icosatetraenoic acid | 5(S)-HPETE | IDI1_033915 | (5S,6E,8Z,11Z,14Z)-5-hydroperoxyic...
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5-Hydroxy-L-tryptophan, Inhibitor of Proton-coupled Amino acid Transporter 1;Inhibitor of Proton-coupled Amino acid Transporter 2Cas#: 4350-09-8 Compound CID: 439280Formula: C11H12N2O3 Molecular Weight: 220.22IUPAC Name: (2S)-2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoic acidSMILES: C1=CC2=C(C=C1O)C(=CN2)CC(C(=O)O)NInChIKey: LDCYZAJDBXYCGN-VIFPVBQESA-NInChI: InChI=1S/C11H12N2O3/c12-9(11(15)16)3-6-5-13-10-2-1-7(14)4-8(6)10/h1-2,4-5,9,13-14H,3,12H2,(H,15,16)/t9-/m0/s1Synonyms: 5-hydroxy-L-tryptophan|L-5-Hydroxytryptophan|oxitriptan|4350-09-8|5-hydroxytryptophan|Levothym|Cincofarm|L-5-Htp|Pret...
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L(+)-Glutamic acidCas#: 56-86-0 Compound CID: 33032Formula: C5H9NO4 Molecular Weight: 147.13IUPAC Name: (2S)-2-aminopentanedioic acidSMILES: C(CC(=O)O)C(C(=O)O)NInChIKey: WHUUTDBJXJRKMK-VKHMYHEASA-NInChI: InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1Synonyms: L-glutamic acid|GLUTAMIC ACID|56-86-0|L-glutamate|(2S)-2-Aminopentanedioic acid|(S)-2-Aminopentanedioic acid|Glutamid...
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L-TryptophanCas#: 73-22-3 Compound CID: 6305Formula: C11H12N2O2 Molecular Weight: 204.23IUPAC Name: (2S)-2-amino-3-(1H-indol-3-yl)propanoic acidSMILES: C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NInChIKey: QIVBCDIJIAJPQS-VIFPVBQESA-NInChI: InChI=1S/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1Synonyms: L-tryptophan|tryptophan|73-22-3|L-Tryptophane|h-Trp-oh|(S)-Tryptophan|Tryptophane|trofan|tryptacin|Ardeytropin|Optima...
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5-oxo-ODE, Agonist of OXE receptorCas#: 1021188-25-9 Compound CID: 71751402Formula: C18H30O3 Molecular Weight: 294.43IUPAC Name: (6E,8Z)-5-oxooctadeca-6,8-dienoic acidSMILES: CCCCCCCCCC=CC=CC(=O)CCCC(=O)OInChIKey: YVWMHFYOIJMUMN-HSINTONASA-NInChI: InChI=1S/C18H30O3/c1-2-3-4-5-6-7-8-9-10-11-12-14-17(19)15-13-16-18(20)21/h10-12,14H,2-9,13,15-16H2,1H3,(H,20,21)/b11-10-,14-12+Synonyms: (6E,8Z)-5-oxooctadecadienoic acid | 5-oxo-ODE | (6E,8Z)-5-Oxo-6,8-octadecadienoic Acid | GTPL6164 | 1021188-25-9 | (6...
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5-oxo-C20:3, Agonist of OXE receptorIUPAC Name: (6Z,8Z,11Z)-5-oxoicosa-6,8,11-trienoic acidSMILES: CCCCCCCC/C=C\C/C=C\C=C/C(=O)CCCC(=O)OInChIKey: ULMVEQWNDGUUBR-IEQFDQMRSA-NInChI: InChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19(21)17-15-18-20(22)23/h9-10,12-14,16H,2-8,11,15,17-18H2,1H3,(H,22,23)/b10-9-,13-12-,16-14-