compound 0052313

Properties Image MNX_ID MNXM1191373 reference envipathM:...b8435f7f18bb formula C7H11O4 global charge -1 mol weight 159.161 InChIKey CKTGUAVYRDXXGO-UHFFFAOYSA-M InChI InChI=1S/C7H12O4/c8-4-2-1-3-5(9)6(4)7(10)11/h4-6,8-9H,1-3H2,(H,10,11)/p-1 SMILES O=C([O-])C1C(O)CCCC1O MNX internals InChI (mnx) InChI=1/C7H12O4/c8-4-2-1-3-5(9)6(4)7(10)11/h4-6,8-9H,1-3H2,(H,10,11)/t4?,5?,6? SMILES (mnx) [CH2:1]1[CH2:2][CH:4]([OH:8])[CH:6]([C:7](=[O:10])[OH:11])[CH:5]([OH:9])[CH2:3]1

Parent-child relations graph

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