compound 0224290

Properties Image MNX_ID MNXM1183853 reference envipathM:...3cf0e512482d formula C17H24NO5 global charge -1 mol weight 322.381 InChIKey XJXOYDCGSAWNEX-UHFFFAOYSA-M InChI InChI=1S/C17H25NO5/c1-4-5-6-14(19)18(9-11(2)3)10-12-7-8-13(17(22)23)16(21)15(12)20/h7-8,11,20-21H,4-6,9-10H2,1-3H3,(H,22,23)/p-1 SMILES CCCCC(=O)N(CC1=CC=C(C(=O)[O-])C(O)=C1O)CC(C)C MNX internals InChI (mnx) InChI=1/C17H25NO5/c1-4-5-6-14(19)18(9-11(2)3)10-12-7-8-13(17(22)23)16(21)15(12)20/h7-8,11,20-21H,4-6,9-10H2,1-3H3,(H,22,23) SMILES (mnx) [CH3:1][CH2:4][CH2:5][CH2:6][C:14]([N:18]([CH2:9][CH:11]([CH3:2])[CH3:3])[CH2:10][C:12]1=[C:15]([OH:20])[C:16]([OH:21])=[C:13]([C:17](=[O:22])[OH:23])[CH:8]=[CH:7]1)=[O:19]

Parent-child relations graph

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