Pseudopteroxazole

Properties Image MNX_ID MNXM108305 reference chebi:66786 formula C21H27NO global charge 0 mol weight 309.453 InChIKey HTRVXIUUWGLCAT-WMHQRMGPSA-N InChI InChI=1S/C21H27NO/c1-11(2)8-15-9-13(4)16-7-6-12(3)17-19(16)18(15)14(5)20-21(17)23-10-22-20/h8,10,12-13,15-16H,6-7,9H2,1-5H3/t12-,13-,15+,16+/m0/s1 SMILES CC(C)=C[C@@H]1C[C@H](C)[C@H]2CC[C@H](C)C3=C2C1=C(C)C1=C3OC=N1 MNX internals InChI (mnx) InChI=1/C21H27NO/c1-11(2)8-15-9-13(4)16-7-6-12(3)17-19(16)18(15)14(5)20-21(17)23-10-22-20/h8,10,12-13,15-16H,6-7,9H2,1-5H3/t12-,13-,15+,16+/m0/s1 SMILES (mnx) [CH3:1][C:11]([CH3:2])=[CH:8][C@@H:15]1[CH2:9][C@H:13]([CH3:4])[C@H:16]2[CH2:7][CH2:6][C@H:12]([CH3:3])[C:17]3=[C:19]2[C:18]1=[C:14]([CH3:5])[C:20]1=[C:21]3[O:23][CH:10]=[N:22]1

Parent-child relations graph

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