681239-95-2
N-[NALPHA,NALPHA-BIS(CARBOXYMETHYL)-L-LYSINE]-12-MERCAPTODODECANAMIDE
NameN-[NALPHA,NALPHA-BIS(CARBOXYMETHYL)-L-LYSINE]-12-MERCAPTODODECANAMIDE
1Identification
【Name】
N-[NALPHA,NALPHA-BIS(CARBOXYMETHYL)-L-LYSINE]-12-MERCAPTODODECANAMIDE
【CAS】
【MDL】
MFCD12912380
【English Synonyms】
【Formula】
C22 H40 N2 O7 S
【MolWeight】
476.631
【Inchi】
InChI=1S/C22H40N2O7S/c25-19(13-8-6-4-2-1-3-5-7-11-15-32)23-14-10-9-12-18(22(30)31)24(16-20(26)27)17-21(28)29/h18,32H,1-17H2,(H,23,25)(H,26,27)(H,28,29)(H,30,31)/t18-/m0/s1
【InChIKey】
InChIKey=DFNBCRSGLOPDAH-SFHVURJKSA-N
【SMILES】
C(CCCCCC(=O)NCCCC[C@@H](C(=O)O)N(CC(=O)O)CC(=O)O)CCCCCS
【MOL File】
N-[NALPHA,NALPHA-BIS….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:4
H bond acceptor:9
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-[NALPHA,NALPHA-BIS(CARBOXYMETHYL)-L-LYSINE]-12-MERCAPTODODECANAMIDE.cml