Swerilactone N

Properties Image MNX_ID MNXM109121 reference chebi:69298 formula C13H14O4 global charge 0 mol weight 234.251 InChIKey JUHKDTASENLCRJ-LBPRGKRZSA-N InChI InChI=1S/C13H14O4/c1-8(14)7-12(15)10-3-2-4-11-9(10)5-6-17-13(11)16/h2-4,12,15H,5-7H2,1H3/t12-/m0/s1 SMILES CC(=O)C[C@H](O)C1=CC=CC2=C1CCOC2=O MNX internals InChI (mnx) InChI=1/C13H14O4/c1-8(14)7-12(15)10-3-2-4-11-9(10)5-6-17-13(11)16/h2-4,12,15H,5-7H2,1H3/t12-/m0/s1 SMILES (mnx) [CH3:1][C:8]([CH2:7][C@@H:12]([C:10]1=[C:9]2[CH2:5][CH2:6][O:17][C:13](=[O:16])[C:11]2=[CH:4][CH:2]=[CH:3]1)[OH:15])=[O:14]

Parent-child relations graph

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