xenorhabdin V

Properties Image MNX_ID MNXM162172 reference metacycM:CPD-17946 formula C13H18N2O2S2 global charge 0 mol weight 298.433 InChIKey KGJPNIILIDNCCD-UHFFFAOYSA-N InChI InChI=1S/C13H18N2O2S2/c1-8(2)5-4-6-10(16)14-11-12-9(7-18-19-12)15(3)13(11)17/h7-8H,4-6H2,1-3H3,(H,14,16) SMILES CC(C)CCCC(=O)NC1=C2SSC=C2N(C)C1=O MNX internals InChI (mnx) InChI=1/C13H18N2O2S2/c1-8(2)5-4-6-10(16)14-11-12-9(7-18-19-12)15(3)13(11)17/h7-8H,4-6H2,1-3H3,(H,14,16) SMILES (mnx) [CH3:1][CH:8]([CH3:2])[CH2:5][CH2:4][CH2:6][C:10](=[N:14][C:11]1=[C:12]2[C:9](=[CH:7][S:18][S:19]2)[N:15]([CH3:3])[C:13]1=[O:17])[OH:16]

Parent-child relations graph

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