2-O-acetylcrinamabine Trifluoroacetic acid

Properties Image Occurences in reactions MNX_ID MNXM101657 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C20H22F3NO8 charge 0 mass 461.12975 reference chebi:68314 InChIKey CBNKNPJYMOTYPO-RQOHTHCISA-N InChI InChI=1S/C18H21NO6.C2HF3O2/c1-10(20)25-13-2-3-18(22)17(16(13)21)4-5-19(18)8-11-6-14-15(7-12(11)17)24-9-23-14;3-2(4,5)1(6)7/h6-7,13,16,21-22H,2-5,8-9H2,1H3;(H,6,7)/t13-,16-,17+,18-;/m0./s1 SMILES CC(=O)O[C@H]1CC[C@@]2(O)N3CC[C@@]2(c2cc4c(cc2C3)OCO4)[C@H]1O.O=C(O)C(F)(F)F

Parent-child relations graph

Deprecated MNXref IDs graph