Tumonoic acid H
AlkaPlorer ID: AK001374
Synonym: None
IUPAC Name: (2S)-3-methyl-2-[(2R)-3-methyl-2-[(2S)-1-[(2S)-2-methyldecanoyl]pyrrolidine-2-carbonyl]oxybutanoyl]oxybutanoic acid
Structure
SMILES: CCCCCCCC[C@H](C)C(=O)N1CCC[C@H]1C(=O)O[C@@H](C(=O)O[C@H](C(=O)O)C(C)C)C(C)C
InChI: InChI=1S/C26H45NO7/c1-7-8-9-10-11-12-14-19(6)23(28)27-16-13-15-20(27)25(31)34-22(18(4)5)26(32)33-21(17(2)3)24(29)30/h17-22H,7-16H2,1-6H3,(H,29,30)/t19-,20-,21-,22+/m0/s1
InChIKey: XZDDLHQSVWZOPD-MYGLTJDJSA-N
Reference
PubChem CID: 25058105
LOTUS: LTS0004073
SuperNatural Ⅲ: SN0443958-02
NPASS: NPC256928
{NPAtlas: NPA000815
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Blennothrix | Oscillatoriaceae | Oscillatoriales | Cyanophyceae | Cyanobacteriota | None | Bacteria |
| None | Cyanobacterium | Geminocystaceae | Chroococcales | Cyanophyceae | Cyanobacteriota | None | Bacteria |
Properties Information
Molecule Weight: 483.6460000000002
TPSA？: 110.21
MolLogP？: 4.584300000000003
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Plasmodium falciparum | Plasmodium falciparum | Activity | None | None | 10.1021/np800088a |