PFAS
全球PFAS筛查数据库
棕榈酰二肽-5(Palmitoyl Dipeptide-5)
棕榈酰二肽-5, Palmitoyl dipeptide-5 diaminohydroxybutyrate trifluoroacetate, Palmitoyllysylvalyldiaminobutyrate trifluoroacetate, L-Valinamide, N-(1-oxohexadecyl)-L-lysyl-N-[(1S)-3-amino-1-carboxypropyl]-, compd. with 2,2,2-trifluoroacetic acid (1:2), N-Palmitoyl-L-lysyl-N-[(1S)-3-amino-1-carboxypropyl]-L-valinamide trifluoroacetate (1:2), Palmitoyllysylvalyldiaminobutyric acid trifluoroacetate, Palmitoyl Dipeptide-6, Palmitoyl Dipeptide-5
CAS号: 794590-34-4
IUPAC名称: (2S)-4-amino-2-[[(2S)-2-[[(2S)-6-amino-2-(hexadecanoylamino)hexanoyl]amino]-3-methylbutanoyl]amino]butanoic acid;bis(2,2,2-trifluoroacetic acid)
分子式: C35H63F6N5O9
分子量: 811.893
InChI: InChI=1S/C31H61N5O5.2C2HF3O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20-27(37)34-25(19-17-18-22-32)29(38)36-28(24(2)3)30(39)35-26(21-23-33)31(40)41;2*3-2(4,5)1(6)7/h24-26,28H,4-23,32-33H2,1-3H3,(H,34,37)(H,35,39)(H,36,38)(H,40,41);2*(H,6,7)/t25-,26-,28-;;/m0../s1
InChIKey: OJGGXQRQSFPREL-OVRRWYLESA-N
SMILES: CCCCCCCCCCCCCCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCN)C(=O)O.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O
EINECS: -


