compound 0057347

Properties Image MNX_ID MNXM1187414 reference envipathM:...391c91278b32 formula C16H25O5 global charge -1 mol weight 297.371 InChIKey QBJWRTQDIKJKAN-UHFFFAOYSA-M InChI InChI=1S/C16H26O5/c1-3-5-8-12(4-2)11-21-15(19)16(20)10-7-6-9-13(16)14(17)18/h6-7,12-13,20H,3-5,8-11H2,1-2H3,(H,17,18)/p-1 SMILES CCCCC(CC)COC(=O)C1(O)CC=CCC1C(=O)[O-] MNX internals InChI (mnx) InChI=1/C16H26O5/c1-3-5-8-12(4-2)11-21-15(19)16(20)10-7-6-9-13(16)14(17)18/h6-7,12-13,20H,3-5,8-11H2,1-2H3,(H,17,18)/t12?,13?,16? SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:8][CH:12]([CH2:4][CH3:2])[CH2:11][O:21][C:15]([C:16]1([OH:20])[CH2:10][CH:7]=[CH:6][CH2:9][CH:13]1[C:14](=[O:17])[OH:18])=[O:19]

Parent-child relations graph

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