Bornelone (USAN/INN)

Properties Image MNX_ID MNXM44587 reference keggD:D03148 formula C14H20O global charge 0 mol weight 204.313 InChIKey WDMFHQNUSVLQMS-XFYQWYMDSA-N InChI InChI=1S/C14H20O/c1-10(15)5-4-6-13-11-7-8-12(9-11)14(13,2)3/h4-6,11-12H,7-9H2,1-3H3/b5-4+,13-6- SMILES CC(=O)/C=C/C=C1/C2CCC(C2)C1(C)C MNX internals InChI (mnx) InChI=1/C14H20O/c1-10(15)5-4-6-13-11-7-8-12(9-11)14(13,2)3/h4-6,11-12H,7-9H2,1-3H3/b5-4+,13-6-/t11?,12? SMILES (mnx) [CH3:1][C:10](/[CH:5]=[CH:4]/[CH:6]=[C:13]1/[CH:11]2[CH2:7][CH2:8][CH:12]([CH2:9]2)[C:14]1([CH3:2])[CH3:3])=[O:15]

Parent-child relations graph

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