Aegle marmelos Alkaloid C

Properties Image MNX_ID MNXM118846 reference hmdb:HMDB0040775 formula C23H27NO3 global charge 0 mol weight 365.473 InChIKey MLCNANOYWKNAAF-ZROIWOOFSA-N InChI InChI=1S/C23H27NO3/c1-18(2)15-16-27-21-12-10-20(11-13-21)22(26-3)17-24-23(25)14-9-19-7-5-4-6-8-19/h4-15,22H,16-17H2,1-3H3,(H,24,25)/b14-9- SMILES COC(CNC(=O)/C=C\C1=CC=CC=C1)C1=CC=C(OCC=C(C)C)C=C1 MNX internals InChI (mnx) InChI=1/C23H27NO3/c1-18(2)15-16-27-21-12-10-20(11-13-21)22(26-3)17-24-23(25)14-9-19-7-5-4-6-8-19/h4-15,22H,16-17H2,1-3H3,(H,24,25)/b14-9-/t22? SMILES (mnx) [CH3:1][C:18]([CH3:2])=[CH:15][CH2:16][O:27][C:21]1=[CH:13][CH:11]=[C:20]([CH:22]([CH2:17]/[N:24]=[C:23](/[CH:14]=[CH:9]\[C:19]2=[CH:7][CH:5]=[CH:4][CH:6]=[CH:8]2)[OH:25])[O:26][CH3:3])[CH:10]=[CH:12]1

Parent-child relations graph

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