Metabolites
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D-erythro-sphingosine-1-phosphate, Agonist of GPR12;Agonist of GPR3;Agonist of GPR63;Agonist of GPR6;Agonist of P2RY10;Agonist of S1P 1 receptor;Agonist of S1P 2 receptor;Agonist of S1P 3 receptor;Agonist of S1P 4 receptor;Agonist of S1P 5 receptorCas#: 26993-30-6 Compound CID: 5283560Formula: C18H38NO5P Molecular Weight: 379.472IUPAC Name: [(E,2S,3R)-2-amino-3-hydroxyoctadec-4-enyl] dihydrogen phosphateSMILES: CCCCCCCCCCCCCC=CC(C(COP(=O)(O)O)N)OInChIKey: DUYSYHSSBDVJSM-KRWOKUGFSA-NInChI: InChI=1S/C18H38NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)17(19)16-24-25(21,22)23/h14-15,17-18,20H,2-13,16,19H2,1H3,(H2,21,22,23)/b15-14+/t17-,18+/m0/s1Synonyms: (2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl dihydrogen phosphate | 4-Octadecene-1,3-diol, 2-amino-, 1-(dihydrogen p...
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4-Aminobutyric AcidCas#: 56-12-2Formula: C4H9NO2 Molecular Weight: 103.12IUPAC Name: 4-aminobutanoic acidSMILES: C(CC(=O)O)CNInChIKey: BTCSSZJGUNDROE-UHFFFAOYSA-NInChI: InChI=1S/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7)Synonyms: 3-Carboxypropylamine | 4-amino-n-butyric acid | butanoic acid, 4-amino- | EPA Pesticide Chemical Code 030802 | Gammal...
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GABACas#: 56-12-2Formula: C4H9NO2 Molecular Weight: 103.12IUPAC Name: 4-aminobutanoic acidSMILES: C(CC(=O)O)CNInChIKey: BTCSSZJGUNDROE-UHFFFAOYSA-NInChI: InChI=1S/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7)Synonyms: 3-Carboxypropylamine | 4-amino-n-butyric acid | butanoic acid, 4-amino- | EPA Pesticide Chemical Code 030802 | Gammal...
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γ-Aminobutyric acid, Agonist of GABA B1;Agonist of GABA B receptorCas#: 56-12-2Formula: C4H9NO2 Molecular Weight: 103.12IUPAC Name: 4-aminobutanoic acidSMILES: C(CC(=O)O)CNInChIKey: BTCSSZJGUNDROE-UHFFFAOYSA-NInChI: InChI=1S/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7)Synonyms: 4-aminobutyric acid|4-Aminobutanoic acid|gamma-aminobutyric acid|GABA|56-12-2|Piperidic acid|Piperidinic acid|Aminalo...
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dolichol phosphate, Inhibitor of mevalonate kinaseCas#: 34457-14-2 Compound CID: 5280322IUPAC Name: {[(6E)-3,7,11-trimethyldodeca-6,10-dien-1-yl]oxy}phosphonic acidSMILES: CC(CC/C=C(/CCC=C(C)C)\C)CCOP(=O)(O)OInChIKey: DZHSRPJGCZHWOM-NTEUORMPSA-NInChI: InChI=1S/C15H29O4P/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-19-20(16,17)18/h7,9,15H,5-6,8,10-12H2,1-4H3,(H2,16,17,18)/b14-9+Synonyms: GTPL3214 | {[(6E)-3,7,11-trimethyldodeca-6,10-dien-1-yl]oxy}phosphonic acid | Q27077096 | [(6E)-3,7,11-Trimethyldodec...
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geranyl diphosphate, Inhibitor of diphosphomevalonate decarboxylase;Inhibitor of mevalonate kinaseCas#: 763-10-0 Compound CID: 445995IUPAC Name: [(2E)-3,7-dimethylocta-2,6-dienyl] phosphono hydrogen phosphateSMILES: C/C(=C\COP(=O)(OP(=O)(O)O)O)/CCC=C(C)CInChIKey: GVVPGTZRZFNKDS-JXMROGBWSA-NInChI: InChI=1S/C10H20O7P2/c1-9(2)5-4-6-10(3)7-8-16-19(14,15)17-18(11,12)13/h5,7H,4,6,8H2,1-3H3,(H,14,15)(H2,11,12,13)/b10-7+Synonyms: (6R,7R)-7-((R)-2-Amino-2-(p-hydroxyphenyl)acetamido)-8-oxo-3-propenyl-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxyli...
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trans,trans-farnesyl diphosphate, Inhibitor of mevalonate kinaseCas#: 372-97-4 Compound CID: 445713IUPAC Name: phosphono 3,7,11-trimethyldodeca-2,6,10-trienyl hydrogen phosphateSMILES: C/C(=C\COP(=O)(OP(=O)(O)O)O)/CC/C=C(/CCC=C(C)C)\CInChIKey: VWFJDQUYCIWHTN-YFVJMOTDSA-NInChI: InChI=1S/C15H28O7P2/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-21-24(19,20)22-23(16,17)18/h7,9,11H,5-6,8,10,12H2,1-4H3,(H,19,20)(H2,16,17,18)/b14-9+,15-11+Synonyms: (E,E)-Farnesyl pyrophosphate | Diphosphoric acid, mono[(2E,6E)-3,7,11-trimethyl-2,6,10-dodecatrienyl] ester | LMPR010...
