(1S,2S,3S)-3-methoxy-2-[(2E)-6-methylhept-2-en-2-yl]-4-oxocyclohexanecarbaldehyde

Properties Image MNX_ID MNXM30519 reference chebi:48411 formula C16H26O3 global charge 0 mol weight 266.381 InChIKey HVCJIYXUPZKLBY-ULVLTVHJSA-N InChI InChI=1S/C16H26O3/c1-11(2)6-5-7-12(3)15-13(10-17)8-9-14(18)16(15)19-4/h7,10-11,13,15-16H,5-6,8-9H2,1-4H3/b12-7+/t13-,15-,16-/m1/s1 SMILES CO[C@@H]1C(=O)CC[C@H](C=O)[C@H]1/C(C)=C/CCC(C)C MNX internals InChI (mnx) InChI=1/C16H26O3/c1-11(2)6-5-7-12(3)15-13(10-17)8-9-14(18)16(15)19-4/h7,10-11,13,15-16H,5-6,8-9H2,1-4H3/b12-7+/t13-,15-,16-/m1/s1 SMILES (mnx) [CH3:1][CH:11]([CH3:2])[CH2:6][CH2:5]/[CH:7]=[C:12](\[CH3:3])[C@@H:15]1[C@@H:13]([CH:10]=[O:17])[CH2:8][CH2:9][C:14](=[O:18])[C@H:16]1[O:19][CH3:4]

Parent-child relations graph

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