CAS 128802-74-4 | L-Phenylalaninamide, N-(3-carboxy-1-oxopropyl)-L-alanyl-L-lysyl-L-prolyl-N-(4-nitrophenyl)- (9CI) | CAS Number 128802-74-4

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128802-74-4 | L-Phenylalaninamide, N-(3-carboxy-1-oxopropyl)-L-alanyl-L-lysyl-L-prolyl-N-(4-nitrophenyl)- (9CI)

CAS No: 128802-74-4 Catalog No: AG000YEF MDL No:

Product Description

Catalog Number:

AG000YEF

Chemical Name:

L-Phenylalaninamide, N-(3-carboxy-1-oxopropyl)-L-alanyl-L-lysyl-L-prolyl-N-(4-nitrophenyl)- (9CI)

CAS Number:

128802-74-4

Molecular Formula:

C33H43N7O9

Molecular Weight:

681.7360

IUPAC Name:

4-[[(2S)-1-[[(2S)-6-amino-1-[(2S)-2-[[(2S)-1-(4-nitroanilino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxohexan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid

InChI:

InChI=1S/C33H43N7O9/c1-21(35-28(41)16-17-29(42)43)30(44)37-25(10-5-6-18-34)33(47)39-19-7-11-27(39)32(46)38-26(20-22-8-3-2-4-9-22)31(45)36-23-12-14-24(15-13-23)40(48)49/h2-4,8-9,12-15,21,25-27H,5-7,10-11,16-20,34H2,1H3,(H,35,41)(H,36,45)(H,37,44)(H,38,46)(H,42,43)/t21-,25-,26-,27-/m0/s1

InChI Key:

JLUAEFLRDYMVJQ-ZYEMSUIVSA-N

SMILES:

NCCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)Nc1ccc(cc1)[N+](=O)[O-])Cc1ccccc1)NC(=O)[C@@H](NC(=O)CCC(=O)O)C