PDB CCD ID: | 1TX |
Number of entries in BioLiP: | 0 |
Chemical formula: | C8 H15 N O4 |
InChI: | InChI=1S/C8H15NO4/c1-13-7(10)5-3-2-4-6(9)8(11)12/h6H,2-5,9H2,1H3,(H,11,12)/t6-/m0/s1 |
InChIKey: | JDVRHBSRVFYFOR-LURJTMIESA-N |
SMILES: | Software | SMILES |
---|
OpenEye OEToolkits 1.7.6 | COC(=O)CCCC[C@@H](C(=O)O)N | ACDLabs 12.01 | O=C(OC)CCCCC(C(=O)O)N | CACTVS 3.370 | COC(=O)CCCC[C@H](N)C(O)=O | OpenEye OEToolkits 1.7.6 | COC(=O)CCCCC(C(=O)O)N | CACTVS 3.370 | COC(=O)CCCC[CH](N)C(O)=O |
|
Name: | (2S)-2-amino-7-methoxy-7-oxoheptanoic acid |
ZINC: | ZINC000013352245 |