isonordoperoxide

Properties Image MNX_ID MNXM105829 reference chebi:66612 formula C15H22O4 global charge 0 mol weight 266.337 InChIKey BDBRZURCDWHOCK-HAWDFTCPSA-N InChI InChI=1S/C15H22O4/c1-8(2)15-6-5-14(4,18-19-15)12-10(16)7-9(3)11(12)13(15)17/h8-9,13,17H,5-7H2,1-4H3/t9-,13?,14+,15+/m1/s1 SMILES CC(C)[C@]12CC[C@](C)(OO1)C1=C(C2O)[C@H](C)CC1=O MNX internals InChI (mnx) InChI=1/C15H22O4/c1-8(2)15-6-5-14(4,18-19-15)12-10(16)7-9(3)11(12)13(15)17/h8-9,13,17H,5-7H2,1-4H3/t9-,13?,14+,15+/m1/s1 SMILES (mnx) [CH3:1][CH:8]([CH3:2])[C@@:15]12[CH2:6][CH2:5][C@@:14]([CH3:4])([C:12]3=[C:11]([C@H:9]([CH3:3])[CH2:7][C:10]3=[O:16])[CH:13]1[OH:17])[O:18][O:19]2

Parent-child relations graph

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