Marinacarboline A

Properties Image MNX_ID MNXM106467 reference chebi:69592 formula C23H21N3O3 global charge 0 mol weight 387.439 InChIKey VKJCZWWGRIELQT-UHFFFAOYSA-N InChI InChI=1S/C23H21N3O3/c1-14(27)21-22-18(17-5-3-4-6-19(17)25-22)13-20(26-21)23(28)24-12-11-15-7-9-16(29-2)10-8-15/h3-10,13,25H,11-12H2,1-2H3,(H,24,28) SMILES COC1=CC=C(CCNC(=O)C2=NC(C(C)=O)=C3NC4=CC=CC=C4C3=C2)C=C1 MNX internals InChI (mnx) InChI=1/C23H21N3O3/c1-14(27)21-22-18(17-5-3-4-6-19(17)25-22)13-20(26-21)23(28)24-12-11-15-7-9-16(29-2)10-8-15/h3-10,13,25H,11-12H2,1-2H3,(H,24,28) SMILES (mnx) [CH3:1][C:14]([C:21]1=[C:22]2[C:18](=[CH:13][C:20]([C:23]([NH:24][CH2:12][CH2:11][C:15]3=[CH:8][CH:10]=[C:16]([O:29][CH3:2])[CH:9]=[CH:7]3)=[O:28])=[N:26]1)[C:17]1=[CH:5][CH:3]=[CH:4][CH:6]=[C:19]1[NH:25]2)=[O:27]

Parent-child relations graph

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