strychnogucine B

Properties Image Occurences in reactions MNX_ID MNXM109067 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C42H42N4O4 charge 0 mass 666.32061 reference chebi:66529 InChIKey MMKIAHOGFMPKCT-LUNGMMDTSA-N InChI InChI=1S/C42H42N4O4/c47-13-9-22-20-43-12-11-41-28-5-1-4-8-31(28)46-38(41)26(24(22)16-34(41)43)15-27(40(46)49)32-19-42-29-6-2-3-7-30(29)45-36(48)18-33-37(39(42)45)25-17-35(42)44(32)21-23(25)10-14-50-33/h1-10,15,24-26,32-35,37-39,47H,11-14,16-21H2/b22-9-/t24-,25-,26-,32+,33-,34-,35-,37-,38-,39-,41+,42+/m0/s1 SMILES O=C1C([C@H]2C[C@@]34c5ccccc5N5C(=O)C[C@@H]6OCC=C7CN2[C@H]3C[C@@H]7[C@@H]6[C@H]54)=C[C@@H]2[C@@H]3N1c1ccccc1[C@@]31CCN3C/C(=C/CO)[C@@H]2C[C@H]31

Parent-child relations graph

Deprecated MNXref IDs graph