EXY
Summary
Name: | 6-[(2R)-oxiran-2-yl]-L-norleucine |
Synonyms: | (2S)-2-amino-7,8-epoxy octanoic acid |
Formula: | C8 H15 N O3 |
Formal charge: | 0 |
Formula weight: | 173.21 Da |
Component type: | L-peptide linking |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 6-[(2R)-oxiran-2-yl]-L-norleucine |
OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-6-[(2R)-oxiran-2-yl]hexanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)C(N)CCCCC1OC1 |
SMILES_CANONICAL | CACTVS | 3.341 | N[C@@H](CCCC[C@@H]1CO1)C(O)=O |
SMILES | CACTVS | 3.341 | N[CH](CCCC[CH]1CO1)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C1[C@H](O1)CCCC[C@@H](C(=O)O)N |
SMILES | OpenEye OEToolkits | 1.5.0 | C1C(O1)CCCCC(C(=O)O)N |
InChI | InChI | 1.03 | InChI=1S/C8H15NO3/c9-7(8(10)11)4-2-1-3-6-5-12-6/h6-7H,1-5,9H2,(H,10,11)/t6-,7+/m1/s1 |
InChIKey | InChI | 1.03 | VESDHWISIJZIDY-RQJHMYQMSA-N |