| PDB CCD ID: | CIV |
| Number of entries in BioLiP: | 0 |
| Chemical formula: | C17 H23 N4 O4 |
| InChI: | InChI=1S/C17H22N4O4/c18-8-2-1-3-13(19)16-20-14(17(25)21(16)10-15(23)24)9-11-4-6-12(22)7-5-11/h4-7,13H,1-3,8-10,18-19H2,(H-,22,23,24)/p+1/t13-/m0/s1 |
| InChIKey: | UNAYNKWNLZGKRW-ZDUSSCGKSA-O |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | NCCCC[C@H](N)C1=[N+](CC(O)=O)C(=O)C(=N1)Cc2ccc(O)cc2 | | CACTVS 3.385 | NCCCC[CH](N)C1=[N+](CC(O)=O)C(=O)C(=N1)Cc2ccc(O)cc2 | | ACDLabs 12.01 | NCCCCC(N)C=1N=C(Cc2ccc(O)cc2)C(=O)[N+]=1CC(N)=O | | OpenEye OEToolkits 2.0.7 | c1cc(ccc1CC2=NC(=[N+](C2=O)CC(=O)O)[C@H](CCCCN)N)O | | OpenEye OEToolkits 2.0.7 | c1cc(ccc1CC2=NC(=[N+](C2=O)CC(=O)O)C(CCCCN)N)O |
|
| Name: | 2-[2-[(1~{S})-1,5-bis(azanyl)pentyl]-4-[(4-hydroxyphenyl)methyl]-5-oxidanylidene-imidazol-1-yl]ethanamide;
CHROMOPHORE (LYS-TYR-GLY) |
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