(2S)-2-(2-azanylethanoylamino)-N-[(3S)-7-azanyl-2-oxidanylidene-heptan-3-yl]-3-(1H-imidazol-5-yl)propanamide; copper; (6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene

Systemtic Name: (2S)-2-(2-azanylethanoylamino)-N-[(3S)-7-azanyl-2-oxidanylidene-heptan-3-yl]-3-(1H-imidazol-5-yl)propanamide; copper; (6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene Openeye Name: (2S)-N-[(1S)-1-acetyl-5-amino-pentyl]-2-[(2-aminoacetyl)amino]-3-(1H-imidazol-5-yl)propanamide; copper; (6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene CAS Name: (2S)-2-[(2-amino-1-oxoethyl)amino]-N-[(3S)-7-amino-2-oxoheptan-3-yl]-3-(1H-imidazol-5-yl)propanamide; copper; (6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene IUPAC Name: (2S)-2-[(2-aminoacetyl)amino]-N-[(3S)-7-amino-2-oxoheptan-3-yl]-3-(1H-imidazol-5-yl)propanamide; copper; (6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene Traditional Name: (2S)-N-[(1S)-1-acetyl-5-amino-pentyl]-2-(glycylamino)-3-(1H-imidazol-5-yl)propionamide; copper; (6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene Formula: C55H82CuN6O3 MolecularWeight: 938.82398

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CC=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC=C(C)CCC=C(C)C)C)C)C)C.CC(=O)C(CCCCN)NC(=O)C(CC1=CN=CN1)NC(=O)CN.[Cu]

Isomeric SMILES

CC(=CCC/C(=C/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=C(/CCC=C(C)C)\C)\C)\C)/C)/C)/C)C.CC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CN)CC1=CN=CN1)CCCCN.[Cu]

InChI

InChI=1S/C40H56.C15H26N6O3.Cu/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4;1-10(22)12(4-2-3-5-16)21-15(24)13(20-14(23)7-17)6-11-8-18-9-19-11;/h11-12,15-22,25-32H,13-14,23-24H2,1-10H3;8-9,12-13H,2-7,16-17H2,1H3,(H,18,19)(H,20,23)(H,21,24);/b12-11+,25-15+,26-16+,31-17+,32-18+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+;;/t;12-,13-;/m.0./s1