compound 0137554

Properties Image MNX_ID MNXM1191670 reference envipathM:...5d456eb0aa7d formula C17H29O7 global charge -1 mol weight 345.412 InChIKey IFEZPUIFCDFCQB-UHFFFAOYSA-M InChI InChI=1S/C17H30O7/c18-11-5-7-12(19)6-4-9-14-17(24-14)16(23)13(20)8-2-1-3-10-15(21)22/h4,6,12-14,16-20,23H,1-3,5,7-11H2,(H,21,22)/p-1 SMILES O=C([O-])CCCCCC(O)C(O)C1OC1CC=CC(O)CCCO MNX internals InChI (mnx) InChI=1/C17H30O7/c18-11-5-7-12(19)6-4-9-14-17(24-14)16(23)13(20)8-2-1-3-10-15(21)22/h4,6,12-14,16-20,23H,1-3,5,7-11H2,(H,21,22)/b6-4?/t12?,13?,14?,16?,17? SMILES (mnx) [CH2:1]([CH2:2][CH2:8][CH:13]([CH:16]([CH:17]1[CH:14]([CH2:9][CH:4]=[CH:6][CH:12]([CH2:7][CH2:5][CH2:11][OH:18])[OH:19])[O:24]1)[OH:23])[OH:20])[CH2:3][CH2:10][C:15](=[O:21])[OH:22]

Parent-child relations graph

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