Tumonoic Acid F
AlkaPlorer ID: AK005373
Synonym: None
IUPAC Name: (2S)-1-[(2S,3S)-3-acetyloxy-2,4-dimethyldodecanoyl]pyrrolidine-2-carboxylic acid
Structure
SMILES: CCCCCCCCC(C)[C@H](OC(C)=O)[C@H](C)C(=O)N1CCC[C@H]1C(=O)O
InChI: InChI=1S/C21H37NO5/c1-5-6-7-8-9-10-12-15(2)19(27-17(4)23)16(3)20(24)22-14-11-13-18(22)21(25)26/h15-16,18-19H,5-14H2,1-4H3,(H,25,26)/t15?,16-,18-,19-/m0/s1
InChIKey: PFYSYVJVRRSPAP-PVRLSMEHSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Blennothrix | Oscillatoriaceae | Oscillatoriales | Cyanophyceae | Cyanobacteriota | None | Bacteria |
| Oscillatoria margaritifera | Oscillatoria | Oscillatoriaceae | Oscillatoriales | Cyanophyceae | Cyanobacteriota | None | Bacteria |
Properties Information
Molecule Weight: 383.52900000000017
TPSA？: 83.91000000000001
MolLogP？: 4.016500000000002
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Plasmodium falciparum | Plasmodium falciparum | Activity | nan | None | 10.1021/np800088a |
| Vibrio harveyi | Vibrio harveyi | IC50 | 62000.0 | nM | 10.1021/np800088a |
| None | Unchecked | Inhibition | nan | % | 10.1021/np200236c |