| PDB CCD ID: | RRV |
| Number of entries in BioLiP: | 2 |
| Chemical formula: | C16 H25 N O4 |
| InChI: | InChI=1S/C16H25NO4/c1-16(2,11-18)14(20)15(21)17-9-8-13(19)10-12-6-4-3-5-7-12/h3-7,13-14,18-20H,8-11H2,1-2H3,(H,17,21)/t13-,14+/m1/s1 |
| InChIKey: | VPOXPYKLLDGWBA-KGLIPLIRSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.7.6 | CC(C)(CO)C(C(=O)NCCC(Cc1ccccc1)O)O | | ACDLabs 12.01 | O=C(NCCC(O)Cc1ccccc1)C(O)C(C)(C)CO | | CACTVS 3.385 | CC(C)(CO)[C@@H](O)C(=O)NCC[C@@H](O)Cc1ccccc1 | | OpenEye OEToolkits 1.7.6 | CC(C)(CO)[C@H](C(=O)NCC[C@H](Cc1ccccc1)O)O | | CACTVS 3.385 | CC(C)(CO)[CH](O)C(=O)NCC[CH](O)Cc1ccccc1 |
|
| Name: | (2R)-2,4-dihydroxy-N-[(3S)-3-hydroxy-4-phenylbutyl]-3,3-dimethylbutanamide |
| ZINC: | ZINC000219656766 |
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