fumiquinazoline C

Properties Image MNX_ID MNXM53992 reference chebi:64551 formula C24H21N5O4 global charge 0 mol weight 443.463 InChIKey POEYRUBMWIOMTB-LTQSKDJASA-N InChI InChI=1S/C24H21N5O4/c1-12-19(31)28-16-10-6-4-8-14(16)24(22(28)25-12)11-17-18(30)27-23(2,33-24)21-26-15-9-5-3-7-13(15)20(32)29(17)21/h3-10,12,17,22,25H,11H2,1-2H3,(H,27,30)/t12-,17+,22-,23-,24-/m0/s1 SMILES C[C@@H]1N[C@H]2N(C1=O)C1=CC=CC=C1[C@@]21C[C@@H]2C(=O)N[C@@](C)(O1)C1=NC3=CC=CC=C3C(=O)N12 MNX internals InChI (mnx) InChI=1/C24H21N5O4/c1-12-19(31)28-16-10-6-4-8-14(16)24(22(28)25-12)11-17-18(30)27-23(2,33-24)21-26-15-9-5-3-7-13(15)20(32)29(17)21/h3-10,12,17,22,25H,11H2,1-2H3,(H,27,30)/t12-,17+,22-,23-,24-/m0/s1 SMILES (mnx) [CH3:1][C@H:12]1[C:19](=[O:31])[N:28]2[C:16]3=[CH:10][CH:6]=[CH:4][CH:8]=[C:14]3[C@@:24]3([CH2:11][C@@H:17]4[C:18]([OH:30])=[N:27][C@:23]([CH3:2])([C:21]5=[N:26][C:15]6=[CH:9][CH:5]=[CH:3][CH:7]=[C:13]6[C:20](=[O:32])[N:29]45)[O:33]3)[C@H:22]2[NH:25]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0