J1J
N-[(2S)-1-({5-[(diaminomethylidene)amino]pentyl}amino)-1-oxo-3-phenylpropan-2-yl]-4-hydroxy-2-oxo-1,2-dihydroquinoline-6-carboxamide
Find entries where: J1J
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | N-[(2S)-1-({5-[(diaminomethylidene)amino]pentyl}amino)-1-oxo-3-phenylpropan-2-yl]-4-hydroxy-2-oxo-1,2-dihydroquinoline-6-carboxamide |
Identifiers | N-[(2S)-1-[5-[bis(azanyl)methylideneamino]pentylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-oxidanyl-2-oxidanylidene-1H-quinoline-6-carboxamide |
Formula | C25 H30 N6 O4 |
Molecular Weight | 478.544 |
Type | NON-POLYMER |
Isomeric SMILES | c1ccc(cc1)C[C@@H](C(=O)NCCCCCN=C(N)N)NC(=O)c2ccc3c(c2)C(=CC(=O)N3)O |
InChI | InChI=1S/C25H30N6O4/c26-25(27)29-12-6-2-5-11-28-24(35)20(13-16-7-3-1-4-8-16)31-23(34)17-9-10-19-18(14-17)21(32)15-22(33)30-19/h1,3-4,7-10,14-15,20H,2,5-6,11-13H2,(H,28,35)(H,31,34)(H4,26,27,29)(H2,30,32,33)/t20-/m0/s1 |
InChIKey | YNWDUXLTOPXBFU-FQEVSTJZSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 65 |
Chiral Atom Count | 1 |
Bond Count | 67 |
Aromatic Bond Count | 12 |
Related Resource References
Resource Name | Reference |
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PubChem | 112499881 |