None
AlkaPlorer ID: AK324835
Synonym: None
IUPAC Name: (3R,4R,5S,6R)-3,5-dihydroxy-4-[(E)-3-hydroxydec-1-enyl]-3-(hydroxymethyl)-6-methylpiperidin-2-one
Structure
SMILES: CCCCCCCC(O)/C=C/[C@@H]1[C@H](O)[C@@H](C)N=C(O)[C@]1(O)CO
InChI: InChI=1S/C17H31NO5/c1-3-4-5-6-7-8-13(20)9-10-14-15(21)12(2)18-16(22)17(14,23)11-19/h9-10,12-15,19-21,23H,3-8,11H2,1-2H3,(H,18,22)/b10-9+/t12-,13?,14-,15-,17+/m1/s1
InChIKey: CCGDBJSPDJSENH-VIJUIKBDSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 329.4370000000001
TPSA？: 113.51
MolLogP？: 1.3231000000000002
Number of H-Donors: 5
Number of H-Acceptors: 5
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Alphaproteobacteria | Alphaproteobacteria | Activity | nan | None | 10.1021/np060170a |
| Bacillus subtilis | Bacillus subtilis | Activity | nan | None | 10.1021/np060170a |
| Candida albicans | Candida albicans | Activity | nan | None | 10.1021/np060170a |
| Escherichia coli | Escherichia coli | Activity | nan | None | 10.1021/np060170a |
| Homo sapiens | A549 | IC50 | 46.4 | ug.mL-1 | 10.1021/np060170a |
| Leeuwenhoekiella marinoflava | Leeuwenhoekiella marinoflava | Activity | nan | None | 10.1021/np060170a |
| Salinivibrio costicola | Salinivibrio costicola | Activity | nan | None | 10.1021/np060170a |
| Staphylococcus aureus | Staphylococcus aureus | Activity | nan | None | 10.1021/np060170a |