fumiquinazoline A

Properties Image MNX_ID MNXM53991 reference chebi:64546 formula C24H23N5O4 global charge 0 mol weight 445.479 InChIKey DQQCCKFZJNINST-VCPZKGNQSA-N InChI InChI=1S/C24H23N5O4/c1-12-19-27-16-9-5-3-7-14(16)22(32)28(19)18(20(30)25-12)11-24(33)15-8-4-6-10-17(15)29-21(31)13(2)26-23(24)29/h3-10,12-13,18,23,26,33H,11H2,1-2H3,(H,25,30)/t12-,13-,18+,23-,24-/m0/s1 SMILES C[C@@H]1N[C@H]2N(C1=O)C1=C(C=CC=C1)[C@@]2(O)C[C@@H]1C(=O)N[C@@H](C)C2=NC3=CC=CC=C3C(=O)N21 MNX internals InChI (mnx) InChI=1/C24H23N5O4/c1-12-19-27-16-9-5-3-7-14(16)22(32)28(19)18(20(30)25-12)11-24(33)15-8-4-6-10-17(15)29-21(31)13(2)26-23(24)29/h3-10,12-13,18,23,26,33H,11H2,1-2H3,(H,25,30)/t12-,13-,18+,23-,24-/m0/s1 SMILES (mnx) [CH3:1][C@H:12]1[C:19]2=[N:27][C:16]3=[CH:9][CH:5]=[CH:3][CH:7]=[C:14]3[C:22](=[O:32])[N:28]2[C@H:18]([CH2:11][C@:24]2([OH:33])[C:15]3=[CH:8][CH:4]=[CH:6][CH:10]=[C:17]3[N:29]3[C:21](=[O:31])[C@H:13]([CH3:2])[NH:26][C@H:23]23)[C:20]([OH:30])=[N:25]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0