compound 0214885

Properties Image MNX_ID MNXM1196572 reference envipathM:...0bb2c1012846 formula C10H13ClO4 global charge 0 mol weight 232.663 InChIKey HVLJOYDTJNSABK-UHFFFAOYSA-N InChI InChI=1S/C10H13ClO4/c1-2-5(12)10(15)8-6(13)3-4-7(14)9(8)11/h3-5,10,12-15H,2H2,1H3 SMILES CCC(O)C(O)C1=C(Cl)C(O)=CC=C1O MNX internals InChI (mnx) InChI=1/C10H13ClO4/c1-2-5(12)10(15)8-6(13)3-4-7(14)9(8)11/h3-5,10,12-15H,2H2,1H3/t5?,10? SMILES (mnx) [CH3:1][CH2:2][CH:5]([CH:10]([C:8]1=[C:6]([OH:13])[CH:3]=[CH:4][C:7]([OH:14])=[C:9]1[Cl:11])[OH:15])[OH:12]

Parent-child relations graph

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