Catalog Number:
AG00IE8C
Chemical Name:
L-Phenylalanine, (aS)-a-aminobenzenebutanoyl-L-leucyl-, methyl ester,mono(trifluoroacetate)
CAS Number:
868539-99-5
Molecular Formula:
C28H36F3N3O6
Molecular Weight:
567.5971
MDL Number:
MFCD28387169
IUPAC Name:
methyl (2S)-2-[[(2S)-2-[[(2S)-2-amino-4-phenylbutanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoate;2,2,2-trifluoroacetic acid
InChI:
InChI=1S/C26H35N3O4.C2HF3O2/c1-18(2)16-22(28-24(30)21(27)15-14-19-10-6-4-7-11-19)25(31)29-23(26(32)33-3)17-20-12-8-5-9-13-20;3-2(4,5)1(6)7/h4-13,18,21-23H,14-17,27H2,1-3H3,(H,28,30)(H,29,31);(H,6,7)/t21-,22-,23-;/m0./s1
InChI Key:
LAPJYAIMBWUZSL-RGRVRPFLSA-N
SMILES:
OC(=O)C(F)(F)F.COC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCc1ccccc1)N)CC(C)C)Cc1ccccc1
