compound 0123406

Properties Image MNX_ID MNXM1182442 reference envipathM:...b7e8ac215b5c formula C17H29O6 global charge -1 mol weight 329.413 InChIKey RTUHDSSQEUDFRH-UHFFFAOYSA-M InChI InChI=1S/C17H30O6/c18-11-7-6-9-15-16(23-15)12-14(20)13(19)8-4-2-1-3-5-10-17(21)22/h13,15-16,18-19H,1-12H2,(H,21,22)/p-1 SMILES O=C([O-])CCCCCCCC(O)C(=O)CC1OC1CCCCO MNX internals InChI (mnx) InChI=1/C17H30O6/c18-11-7-6-9-15-16(23-15)12-14(20)13(19)8-4-2-1-3-5-10-17(21)22/h13,15-16,18-19H,1-12H2,(H,21,22)/t13?,15?,16? SMILES (mnx) [CH2:1]([CH2:2][CH2:4][CH2:8][CH:13]([C:14]([CH2:12][CH:16]1[CH:15]([CH2:9][CH2:6][CH2:7][CH2:11][OH:18])[O:23]1)=[O:20])[OH:19])[CH2:3][CH2:5][CH2:10][C:17](=[O:21])[OH:22]

Parent-child relations graph

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