tumonoic acid B
AlkaPlorer ID: AK008797
Synonym: 'Tumonic acid B', '(2S)-2-(2R,3S)-2-(2S)-1-(E,2R,3S)-3-hydroxy-2,4-dimethyldodec-4-enoylpyrrolidine-2-carbonyloxy-3-methylpentanoyloxypropanoic acid'
IUPAC Name: (2S)-2-[(2R,3S)-2-[(2S)-1-[(E,2R,3S)-3-hydroxy-2,4-dimethyldodec-4-enoyl]pyrrolidine-2-carbonyl]oxy-3-methylpentanoyl]oxypropanoic acid
Structure
SMILES: CCCCCCC/C=C(\C)[C@@H](O)[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O[C@@H](C(=O)O[C@@H](C)C(=O)O)[C@@H](C)CC
InChI: InChI=1S/C28H47NO8/c1-7-9-10-11-12-13-15-19(4)23(30)20(5)25(31)29-17-14-16-22(29)27(34)37-24(18(3)8-2)28(35)36-21(6)26(32)33/h15,18,20-24,30H,7-14,16-17H2,1-6H3,(H,32,33)/b19-15+/t18-,20+,21-,22-,23+,24+/m0/s1
InChIKey: HYPDCGGBAFGHKA-JILBMGCCSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Oscillatoria margaritifera | Oscillatoria | Oscillatoriaceae | Oscillatoriales | Cyanophyceae | Cyanobacteriota | None | Bacteria |
Properties Information
Molecule Weight: 525.6830000000003
TPSA？: 130.44
MolLogP？: 4.2554000000000025
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|