L-Phenylalanine, (αS)-α-aminobenzenebutanoyl-L-leucyl-, methyl ester, 2,2,2-trifluoroacetate (1:1)
CAS Registry Number®
868539-99-5
CAS Name
L-Phenylalanine, (αS)-α-aminobenzenebutanoyl-L-leucyl-, methyl ester, 2,2,2-trifluoroacetate (1:1)Molecular Formula
C26H35N3O4.C2HF3O2Cite this Page
L-Phenylalanine, (αS)-α-aminobenzenebutanoyl-L-leucyl-, methyl ester, 2,2,2-trifluoroacetate (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=868539-99-5 (retrieved ) (CAS RN: 868539-99-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
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
InChIKey
InChIKey=LAPJYAIMBWUZSL-RGRVRPFLSA-N
SMILES
[C@H](C(N[C@@H](CC1=CC=CC=C1)C(OC)=O)=O)(NC([C@H](CCC2=CC=CC=C2)N)=O)CC(C)C.C(C(O)=O)(F)(F)F
Canonical SMILES
O=C(O)C(F)(F)F.O=C(OC)C(NC(=O)C(NC(=O)C(N)CCC=1C=CC=CC1)CC(C)C)CC=2C=CC=CC2
Other Names for this Substance
- L-Phenylalanine, (αS)-α-aminobenzenebutanoyl-L-leucyl-, methyl ester, 2,2,2-trifluoroacetate (1:1)
- L-Phenylalanine, (αS)-α-aminobenzenebutanoyl-L-leucyl-, methyl ester, mono(trifluoroacetate)
