tumonoic acid A
AlkaPlorer ID: AK007378
Synonym: 'Tumonoic acid A', 'Tumonic acid A', '1-(2R,3S,4E)-3-Hydroxy-2,4-dimethyl-4-dodecenoyl-L-proline', '(-)-Tumonoic acid A'
IUPAC Name: (2S)-1-[(E,2R,3S)-3-hydroxy-2,4-dimethyldodec-4-enoyl]pyrrolidine-2-carboxylic acid
Structure
SMILES: CCCCCCC/C=C(\C)[C@@H](O)[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O
InChI: InChI=1S/C19H33NO4/c1-4-5-6-7-8-9-11-14(2)17(21)15(3)18(22)20-13-10-12-16(20)19(23)24/h11,15-17,21H,4-10,12-13H2,1-3H3,(H,23,24)/b14-11+/t15-,16+,17-/m1/s1
InChIKey: JFFANXXIOVCBBG-PYIPWEHNSA-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: 339.4760000000001
TPSA？: 77.84
MolLogP？: 3.365800000000002
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Plasmodium falciparum | Plasmodium falciparum | Activity | None | None | 10.1021/np800088a |
| None | Unchecked | Inhibition | None | % | 10.1021/np200236c |