| PDB CCD ID: | AYC |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C8 H13 N O4 |
| InChI: | InChI=1S/C8H13NO4/c1-5(9-6(2)10)7(11)3-4-8(12)13/h5H,3-4H2,1-2H3,(H,9,10)(H,12,13)/t5-/m1/s1 |
| InChIKey: | QSRUAKBTZTXXLM-RXMQYKEDSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.352 | C[CH](NC(C)=O)C(=O)CCC(O)=O | | OpenEye OEToolkits 1.6.1 | CC(C(=O)CCC(=O)O)NC(=O)C | | CACTVS 3.352 | C[C@@H](NC(C)=O)C(=O)CCC(O)=O | | ACDLabs 10.04 | O=C(C(NC(=O)C)C)CCC(=O)O | | OpenEye OEToolkits 1.6.1 | C[C@H](C(=O)CCC(=O)O)NC(=O)C |
|
| Name: | ALAREMYCIN 2;
(5R)-5-ACETAMIDO-4-OXO-HEXANOIC ACID |
| ChEMBL: | CHEMBL1231117 |
| ZINC: | ZINC000058626709 |
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