Cedryl acetate

Properties Image MNX_ID MNXM120349 reference chebi:172505 formula C17H28O2 global charge 0 mol weight 264.409 InChIKey HQKQRXZEXPXXIG-DTWJZALFSA-N InChI InChI=1S/C17H28O2/c1-11-6-7-13-15(3,4)14-10-17(11,13)9-8-16(14,5)19-12(2)18/h11,13-14H,6-10H2,1-5H3/t11-,13+,14-,16-,17+/m1/s1 SMILES CC(=O)O[C@]1(C)CC[C@@]23C[C@@H]1C(C)(C)[C@@H]2CC[C@H]3C MNX internals InChI (mnx) InChI=1/C17H28O2/c1-11-6-7-13-15(3,4)14-10-17(11,13)9-8-16(14,5)19-12(2)18/h11,13-14H,6-10H2,1-5H3/t11-,13+,14-,16-,17+/m1/s1 SMILES (mnx) [CH3:1][C@@H:11]1[CH2:6][CH2:7][C@H:13]2[C:15]([CH3:3])([CH3:4])[C@H:14]3[CH2:10][C@@:17]12[CH2:9][CH2:8][C@@:16]3([CH3:5])[O:19][C:12]([CH3:2])=[O:18]

Parent-child relations graph

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