Gallicynoic acid A

Properties Image MNX_ID MNXM1130373 reference chebi:210572 formula C14H22O4 global charge 0 mol weight 254.326 InChIKey WSAOFJBMEVAKDJ-ODBCZPJSSA-N InChI InChI=1S/C14H22O4/c1-2-3-7-12(15)10-11-13(16)8-5-4-6-9-14(17)18/h5,8,12-13,15-16H,2-4,6-7,9H2,1H3,(H,17,18)/b8-5-/t12-,13+/m1/s1 SMILES CCCC[C@@H](O)C#C[C@@H](O)/C=C\CCCC(=O)O MNX internals InChI (mnx) InChI=1/C14H22O4/c1-2-3-7-12(15)10-11-13(16)8-5-4-6-9-14(17)18/h5,8,12-13,15-16H,2-4,6-7,9H2,1H3,(H,17,18)/b8-5-/t12-,13+/m1/s1 SMILES (mnx) [CH3:1][CH2:2][CH2:3][CH2:7][C@H:12]([C:10]#[C:11][C@H:13](/[CH:8]=[CH:5]\[CH2:4][CH2:6][CH2:9][C:14](=[O:17])[OH:18])[OH:16])[OH:15]

Parent-child relations graph

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