|
LEU : Summary
Code
|
LEU
|
One-letter code
|
L
|
Molecule name
|
LEUCINE
|
Systematic names
|
|
Formula
|
C6 H13 N O2
|
Formal charge
|
0
|
Molecular weight
|
131.173 Da
|
SMILES
|
Type | Program | Version | Descriptor |
SMILES
|
ACDLabs |
10.04 |
O=C(O)C(N)CC(C)C |
SMILES
|
CACTVS |
3.341 |
CC(C)C[CH](N)C(O)=O |
SMILES
|
OpenEye OEToolkits |
1.5.0 |
CC(C)CC(C(=O)O)N |
Canonical SMILES
|
CACTVS |
3.341 |
CC(C)C[C@H](N)C(O)=O |
Canonical SMILES
|
OpenEye OEToolkits |
1.5.0 |
CC(C)C[C@@H](C(=O)O)N |
|
IUPAC InChI | InChI=1S/C6H13NO2/c1-4(2)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m0/s1 |
IUPAC InChI key | ROHFNLRQFUQHCH-YFKPBYRVSA-N |
Is part of |
VR4
, UBY
, ZU5
, V69
, X32
, RSY
, XLI
, V56
, UBT
, UBS
, ZU3
, RA4
, RA8
, RDF
, LDZ
, UB2
, UBZ
, UBW
, UB3
, UBV
, ZIL
|
|
wwPDB Information |
Atom count
|
22 (9 without Hydrogen)
|
Polymer type
|
Amino Acid
|
Type description
|
L-PEPTIDE LINKING
|
Type code
|
ATOMP
|
Is modified
|
No
|
Standard parent
|
Not Assigned
|
Defined at
|
1999-07-08
|
Last modified at
|
2023-11-03
|
Status
|
Released
|
Obsoleted
|
Not Assigned
|
|