Metabolites

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  1. 1,2-Dioctanoyl-sn-glycerol, Activator of TRPC7
    Cas#: 60514-48-9        Compound CID:  148879
    Formula:  C19H36O5        Molecular Weight: 344.49
    IUPAC Name: [(2S)-3-hydroxy-2-octanoyloxypropyl] octanoate
    SMILES: CCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCC
    InChIKey: ZQBULZYTDGUSSK-KRWDZBQOSA-N
    InChI: InChI=1S/C19H36O5/c1-3-5-7-9-11-13-18(21)23-16-17(15-20)24-19(22)14-12-10-8-6-4-2/h17,20H,3-16H2,1-2H3/t17-/m0/s1
    Synonyms: KBioSS_000011 | Octanoic acid 1-hydroxymethyl-2-octanoyloxy-ethyl ester | GTPL2435 | sn-1,2-dicaprilin | Bio2_000011 ...
  2. 1,2-Dioctanoyl-sn-glycerol
    Cas#: 60514-48-9        Compound CID:  148879
    Formula:  C19H36O5        Molecular Weight: 344.49
    IUPAC Name: [(2S)-3-hydroxy-2-octanoyloxypropyl] octanoate
    SMILES: CCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCC
    InChIKey: ZQBULZYTDGUSSK-KRWDZBQOSA-N
    InChI: InChI=1S/C19H36O5/c1-3-5-7-9-11-13-18(21)23-16-17(15-20)24-19(22)14-12-10-8-6-4-2/h17,20H,3-16H2,1-2H3/t17-/m0/s1
    Synonyms: KBioSS_000011 | Octanoic acid 1-hydroxymethyl-2-octanoyloxy-ethyl ester | GTPL2435 | sn-1,2-dicaprilin | Bio2_000011 ...
  3. 1,2-Dioctanoyl-sn-glycerol
    Cas#: 60514-48-9        Compound CID:  148879
    Formula:  C19H36O5        Molecular Weight: 344.49
    IUPAC Name: [(2S)-3-hydroxy-2-octanoyloxypropyl] octanoate
    SMILES: CCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCC
    InChIKey: ZQBULZYTDGUSSK-KRWDZBQOSA-N
    InChI: InChI=1S/C19H36O5/c1-3-5-7-9-11-13-18(21)23-16-17(15-20)24-19(22)14-12-10-8-6-4-2/h17,20H,3-16H2,1-2H3/t17-/m0/s1
    Synonyms: 1,2-dioctanoyl-sn-glycerol|60514-48-9|sn-1,2-Dioctanoylglycerol|Dicaprylglyceride|(S)-3-Hydroxypropane-1,2-diyl dioct...
  4. OAG, Activator of TRPC3;Activator of TRPC6;Activator of TRPC7
    Cas#: 84746-00-9        Compound CID:  5353264
    IUPAC Name: (2-acetyloxy-3-hydroxypropyl) (E)-octadec-9-enoate
    SMILES: CCCCCCCC/C=C/CCCCCCCC(=O)OCC(OC(=O)C)CO
    InChIKey: PWTCCMJTPHCGMS-ZHACJKMWSA-N
    InChI: InChI=1S/C23H42O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(26)27-20-22(19-24)28-21(2)25/h10-11,22,24H,3-9,12-20H2,1-2H3/b11-10+
    Synonyms: 1-oleoyl-2-acetyl-sn-glycerol
  5. pregnenolone sulphate, Antagonist of glycine receptor α1 subunit;Antagonist of glycine receptor α2 subunit;Antagonist of glycine receptor β subunit;Activator of TRPM1;Activator of TRPM3
    Cas#: 1247-64-9        Compound CID:  105074
    IUPAC Name: [(3S,8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate
    SMILES: CC(=O)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OS(=O)(=O)O)C)C
    InChIKey: DIJBBUIOWGGQOP-QGVNFLHTSA-N
    InChI: InChI=1S/C21H32O5S/c1-13(22)17-6-7-18-16-5-4-14-12-15(26-27(23,24)25)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,15-19H,5-12H2,1-3H3,(H,23,24,25)/t15-,16-,17+,18-,19-,20-,21+/m0/s1
    Synonyms: CMC_13403 | BDBM50503144 | UNII-04Y4D91RG0 | PREGS | Pregnenolone monosulfate | [3H]pregnenolone sulphate | LUZRJRNZX...
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