Asn-Ala-Arg

Properties Image MNX_ID MNXM167131 reference sabiorkM:26890 formula C13H25N7O5 global charge 0 mol weight 359.387 InChIKey PFOYSEIHFVKHNF-UHFFFAOYSA-N InChI InChI=1S/C13H25N7O5/c1-6(19-11(23)7(14)5-9(15)21)10(22)20-8(12(24)25)3-2-4-18-13(16)17/h6-8H,2-5,14H2,1H3,(H2,15,21)(H,19,23)(H,20,22)(H,24,25)(H4,16,17,18) SMILES CC(N=C(O)C(N)CC(=N)O)C(O)=NC(CCCNC(=N)N)C(=O)O MNX internals InChI (mnx) InChI=1/C13H25N7O5/c1-6(19-11(23)7(14)5-9(15)21)10(22)20-8(12(24)25)3-2-4-18-13(16)17/h6-8H,2-5,14H2,1H3,(H2,15,21)(H,19,23)(H,20,22)(H,24,25)(H4,16,17,18)/t6?,7?,8? SMILES (mnx) [CH3:1][CH:6]([C:10](=[N:20][CH:8]([CH2:3][CH2:2][CH2:4][NH:18][C:13](=[NH:16])[NH2:17])[C:12](=[O:24])[OH:25])[OH:22])[N:19]=[C:11]([CH:7]([CH2:5][C:9](=[NH:15])[OH:21])[NH2:14])[OH:23]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0