CAS 138486-85-8 | L-Methioninamide, N-(4-methoxy-1,4-dioxobutyl)-L-α-glutamyl-L-valyl-L-lysyl-N-(4-nitrophenyl)- (9CI) | CAS Number 138486-85-8

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138486-85-8 | L-Methioninamide, N-(4-methoxy-1,4-dioxobutyl)-L-α-glutamyl-L-valyl-L-lysyl-N-(4-nitrophenyl)- (9CI)

CAS No: 138486-85-8 Catalog No: AG0019A6 MDL No:

Product Description

Catalog Number:

AG0019A6

Chemical Name:

L-Methioninamide, N-(4-methoxy-1,4-dioxobutyl)-L-α-glutamyl-L-valyl-L-lysyl-N-(4-nitrophenyl)- (9CI)

CAS Number:

138486-85-8

Molecular Formula:

C32H49N7O11S

Molecular Weight:

739.8368

IUPAC Name:

(4S)-5-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-4-methylsulfanyl-1-(4-nitroanilino)-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-[(4-methoxy-4-oxobutanoyl)amino]-5-oxopentanoic acid

InChI:

InChI=1S/C32H49N7O11S/c1-19(2)28(38-31(46)23(12-14-26(41)42)35-25(40)13-15-27(43)50-3)32(47)37-22(7-5-6-17-33)30(45)36-24(16-18-51-4)29(44)34-20-8-10-21(11-9-20)39(48)49/h8-11,19,22-24,28H,5-7,12-18,33H2,1-4H3,(H,34,44)(H,35,40)(H,36,45)(H,37,47)(H,38,46)(H,41,42)/t22-,23-,24-,28-/m0/s1

InChI Key:

VPECJYHAAXDMGP-TVQWTUMOSA-N

SMILES:

NCCCC[C@@H](C(=O)N[C@H](C(=O)Nc1ccc(cc1)[N+](=O)[O-])CCSC)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)CCC(=O)OC)CCC(=O)O