53807-05-9
PHENYLALANYL-GLYCYL-PROLYL-PHENYLALANYL-ARGININE
NamePHENYLALANYL-GLYCYL-PROLYL-PHENYLALANYL-ARGININE
1Identification
【Name】
PHENYLALANYL-GLYCYL-PROLYL-PHENYLALANYL-ARGININE
【CAS】
【MDL】
MFCD21608935
【English Synonyms】
【Formula】
C31 H42 N8 O6
【MolWeight】
622.723
【Inchi】
InChI=1S/C31H42N8O6/c32-22(17-20-9-3-1-4-10-20)27(41)36-19-26(40)39-16-8-14-25(39)29(43)38-24(18-21-11-5-2-6-12-21)28(42)37-23(30(44)45)13-7-15-35-31(33)34/h1-6,9-12,22-25H,7-8,13-19,32H2,(H,36,41)(H,37,42)(H,38,43)(H,44,45)(H4,33,34,35)/t22-,23-,24-,25-/m0/s1
【InChIKey】
InChIKey=MHGIZRIARZNIBU-QORCZRPOSA-N
【SMILES】
c1ccc(cc1)C[C@@H](C(=O)NCC(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc3ccccc3)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)N
【MOL File】
PHENYLALANYL-GLYCYL-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:8
H bond acceptor:14
XLogP3:-5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
PHENYLALANYL-GLYCYL-PROLYL-PHENYLALANYL-ARGININE.cml