debromolaurinterol

Properties Image MNX_ID MNXM104256 reference chebi:66556 formula C15H20O global charge 0 mol weight 216.324 InChIKey XQATUTRQDIODTL-UGFHNGPFSA-N InChI InChI=1S/C15H20O/c1-10-4-5-12(13(16)8-10)14(2)7-6-11-9-15(11,14)3/h4-5,8,11,16H,6-7,9H2,1-3H3/t11-,14+,15+/m1/s1 SMILES CC1=CC(O)=C([C@]2(C)CC[C@@H]3C[C@@]32C)C=C1 MNX internals InChI (mnx) InChI=1/C15H20O/c1-10-4-5-12(13(16)8-10)14(2)7-6-11-9-15(11,14)3/h4-5,8,11,16H,6-7,9H2,1-3H3/t11-,14+,15+/m1/s1 SMILES (mnx) [CH3:1][C:10]1=[CH:8][C:13]([OH:16])=[C:12]([C@:14]2([CH3:2])[CH2:7][CH2:6][C@@H:11]3[CH2:9][C@@:15]32[CH3:3])[CH:5]=[CH:4]1

Parent-child relations graph

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