Metabolites

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  1. KRN-633, Vascular endothelial growth factor receptor inhibitor
    Cas#: 286370-15-8        Compound CID:  9549295
    Formula:  C20H21ClN4O4        Molecular Weight: 416.87
    IUPAC Name: 1-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-3-propylurea
    SMILES: CCCNC(=O)NC1=C(C=C(C=C1)OC2=NC=NC3=CC(=C(C=C32)OC)OC)Cl
    InChIKey: VPBYZLCHOKSGRX-UHFFFAOYSA-N
    InChI: InChI=1S/C20H21ClN4O4/c1-4-7-22-20(26)25-15-6-5-12(8-14(15)21)29-19-13-9-17(27-2)18(28-3)10-16(13)23-11-24-19/h5-6,8-11H,4,7H2,1-3H3,(H2,22,25,26)
    Synonyms: 1-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-3-propylurea | 1-(2-chloro-4-((6,7-dimethoxyquinazolin-4-yl)ox...
  2. meso-2,6-Diaminopimelic acid, Agonist of nucleotide binding oligomerization domain containing 1
    Cas#: 922-54-3        Compound CID:  99290
    Formula:  C7H14N2O4        Molecular Weight: 190.2
    IUPAC Name: (2S,6R)-2,6-diaminoheptanedioic acid
    SMILES: C(CC(C(=O)O)N)CC(C(=O)O)N
    InChIKey: GMKMEZVLHJARHF-SYDPRGILSA-N
    InChI: InChI=1S/C7H14N2O4/c8-4(6(10)11)2-1-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5+
    Synonyms: AKOS006328542 | C00680 | Heptanedioic acid, 2,6-diamino-, meso- (8CI) | meso-2,6-diaminoheptanedioate | meso-1-alpha,...
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