fusicoauritone

Properties Image MNX_ID MNXM105264 reference chebi:67831 formula C20H32O2 global charge 0 mol weight 304.474 InChIKey UHLQGMSCOUMZFU-UIGPTYSNSA-N InChI InChI=1S/C20H32O2/c1-12(2)15-8-9-19(5)10-17-14(4)18(21)11-20(17,22)13(3)6-7-16(15)19/h12-13,15-16,22H,6-11H2,1-5H3/t13-,15+,16-,19+,20+/m0/s1 SMILES CC1=C2C[C@@]3(C)CC[C@H](C(C)C)[C@@H]3CC[C@H](C)[C@]2(O)CC1=O MNX internals InChI (mnx) InChI=1/C20H32O2/c1-12(2)15-8-9-19(5)10-17-14(4)18(21)11-20(17,22)13(3)6-7-16(15)19/h12-13,15-16,22H,6-11H2,1-5H3/t13-,15+,16-,19+,20+/m0/s1 SMILES (mnx) [CH3:1][CH:12]([CH3:2])[C@H:15]1[CH2:8][CH2:9][C@:19]2([CH3:5])[CH2:10][C:17]3=[C:14]([CH3:4])[C:18](=[O:21])[CH2:11][C@@:20]3([OH:22])[C@@H:13]([CH3:3])[CH2:6][CH2:7][C@@H:16]12

Parent-child relations graph

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