-
(2S)-2-amino-6-{[(benzyloxy)carbonyl]amino}hexanoic acid
-
ChemBase ID:
59942
-
Molecular Formular:
C14H20N2O4
-
Molecular Mass:
280.3196
-
Monoisotopic Mass:
280.14230713
-
SMILES and InChIs
SMILES:
C(=O)(OCc1ccccc1)NCCCC[C@@H](C(=O)O)N
Canonical SMILES:
O=C(OCc1ccccc1)NCCCC[C@@H](C(=O)O)N
InChI:
InChI=1S/C14H20N2O4/c15-12(13(17)18)8-4-5-9-16-14(19)20-10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10,15H2,(H,16,19)(H,17,18)/t12-/m0/s1
InChIKey:
CKGCFBNYQJDIGS-LBPRGKRZSA-N
-
Cite this record
CBID:59942 http://www.chembase.cn/molecule-59942.html
NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
(2S)-2-amino-6-{[(benzyloxy)carbonyl]amino}hexanoic acid
|
|
|
IUPAC Traditional name
|
(2S)-2-amino-6-{[(benzyloxy)carbonyl]amino}hexanoic acid
|
|
|
Synonyms
|
N(epsilon)-Cbz-L-Lysine
|
N(epsilon)-Benzyloxycarbonyl-L-lysine
|
H-Lys(Z)-OH
|
N6-[(Phenylmethoxy)carbonyl]-L-lysine
|
N-ε-Benzoyloxycarbonyllysine
|
N6-(Benzyloxycarbonyl)-L-lysine
|
Nε-Z-L-lysine
|
N6-Carbobenzyloxy-L-lysine
|
H-Lys(Z)-OH
|
EPSILON-CARBOBENZOXY-L-LYSINE
|
H-Lys(Z)-OH
|
N-epsilon-CBZ-L-LYSINE
|
N~6~-[(benzyloxy)carbonyl]-L-lysine
|
N(ε)-苄氧羰基-L-赖氨酸
|
Nε-苄氧羰基-L-赖氨酸
|
N6-Cbz-L-赖氨酸
|
|
|
CAS Number
|
|
EC Number
|
|
MDL Number
|
|
Beilstein Number
|
|
PubChem SID
|
|
PubChem CID
|
|
DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
|
1.9827216
|
H Acceptors
|
4
|
H Donor
|
3
|
LogD (pH = 5.5)
|
-0.81052226
|
LogD (pH = 7.4)
|
-0.81343323
|
Log P
|
-0.81053084
|
Molar Refractivity
|
73.4895 cm3
|
Polarizability
|
29.024624 Å3
|
Polar Surface Area
|
101.65 Å2
|
Rotatable Bonds
|
9
|
Lipinski's Rule of Five
|
true
|
DETAILS
DETAILS
MP Biomedicals
Sigma Aldrich
TRC
PATENTS
PATENTS
PubChem Patent
Google Patent