PRD_000307

N-acetyl-6-ammonio-L-norleucyl-L-glutaminyl-N-[(1S)-4-{[amino(iminio)methyl]amino}-1-(chloroacetyl)butyl]-L-leucinamide

PRD_000307 is described in the Biologically Interesting Molecule Reference Dictionary (BIRD).

The representative PDB ID is 1Z8G.

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Chemical Component Summary

NameN-acetyl-6-ammonio-L-norleucyl-L-glutaminyl-N-[(1S)-4-{[amino(iminio)methyl]amino}-1-(chloroacetyl)butyl]-L-leucinamide
Identifiers[[[(4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-6-azaniumyl-hexanoyl]amino]-5-azanyl-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoyl]amino]-6-chloranyl-5-oxidanyl-hexyl]amino]-azanyl-methylidene]azanium
FormulaC26 H52 Cl N9 O6
Molecular Weight622.201
TypePEPTIDE-LIKE
Isomeric SMILESCC(C)C[C@@H](C(=O)N[C@@H](CCCNC(=[NH2+])N)C(CCl)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCC[NH3+])NC(=O)C
InChIInChI=1S/C26H50ClN9O6/c1-15(2)13-20(25(42)34-17(21(38)14-27)8-6-12-32-26(30)31)36-24(41)19(9-10-22(29)39)35-23(40)18(33-16(3)37)7-4-5-11-28/h15,17-21,38H,4-14,28H2,1-3H3,(H2,29,39)(H,33,37)(H,34,42)(H,35,40)(H,36,41)(H4,30,31,32)/p+2/t17-,18?,19?,20?,21?/m1/s1
InChIKeyLTZUUKWTOKOZAV-QPCUUSJWSA-P
CompositionPolymer Sequences: ACE-LYS-GLN-LEU-AR7-0QE
BIRD classINHIBITOR
Represented AsPOLYMER
Compound Detailsn/a
Descriptionn/a

Chemical Details

Formal Charge0
Atom Count94
Chiral Atom Count4
Bond Count93
Aromatic Bond Count0