Cybastacine A
AlkaPlorer ID: AK112742
Synonym: 'Cybastacine A'
IUPAC Name: (2S,5R,10S,11R,13R,15S,20S)-7-amino-2,5,11,15,19,19-hexamethyl-6,8-diazapentacyclo[12.8.0.02,11.05,10.015,20]docosa-1(14),7-dien-13-ol
Structure
SMILES: CC1(C)CCC[C@]2(C)C3=C(CC[C@@H]12)[C@@]1(C)CC[C@@]2(C)NC(=N)NC[C@@H]2[C@@]1(C)C[C@H]3O
InChI: InChI=1S/C26H43N3O/c1-22(2)10-7-11-23(3)18(22)9-8-16-20(23)17(30)14-25(5)19-15-28-21(27)29-26(19,6)13-12-24(16,25)4/h17-19,30H,7-15H2,1-6H3,(H3,27,28,29)/t17-,18+,19-,23+,24-,25-,26-/m1/s1
InChIKey: RQEHMIXSAUDXKZ-PVQKCIGPSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 413.65
TPSA？: 68.14
MolLogP？: 4.982870000000005
Number of H-Donors: 4
Number of H-Acceptors: 2
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Enterococcus faecalis | Enterococcus faecalis | MIC | 32.0 | ug.mL-1 | 10.1021/acs.jnatprod.7b00638 |
| Enterococcus faecium | Enterococcus faecium | MIC | 32.0 | ug.mL-1 | 10.1021/acs.jnatprod.7b00638 |
| Mycobacteroides abscessus | Mycobacteroides abscessus | MIC | 16.0 | ug.mL-1 | 10.1021/acs.jnatprod.7b00638 |
| Nocardia carnea | Nocardia carnea | MIC | 16.0 | ug.mL-1 | 10.1021/acs.jnatprod.7b00638 |
| Nocardia cyriacigeorgica | Nocardia cyriacigeorgica | MIC | 16.0 | ug.mL-1 | 10.1021/acs.jnatprod.7b00638 |
| Staphylococcus aureus | Staphylococcus aureus | MIC | 32.0 | ug.mL-1 | 10.1021/acs.jnatprod.7b00638 |
| Staphylococcus epidermidis | Staphylococcus epidermidis | MIC | 32.0 | ug.mL-1 | 10.1021/acs.jnatprod.7b00638 |
| Streptococcus pyogenes | Streptococcus pyogenes | MIC | 32.0 | ug.mL-1 | 10.1021/acs.jnatprod.7b00638 |
| Tsukamurella pulmonis | Tsukamurella pulmonis | MIC | 8.0 | ug.mL-1 | 10.1021/acs.jnatprod.7b00638 |