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CHEBI:69208 - tumonoic acid B

ChEBI IDCHEBI:69208
ChEBI Nametumonoic acid B
Stars
DefinitionA natural product found particularly in Oscillatoria margaritifera and Oscillatoria margaritifera.
Last Modified22 September 2014
DownloadsMolfile
FormulaC28H47NO8
Net Charge0
Average Mass525.683
Monoisotopic Mass525.33017
SMILESCCCCCCC/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
InChIInChI=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
InChIKeyHYPDCGGBAFGHKA-JILBMGCCSA-N
Species of MetaboliteComponentSourceComments
Oscillatoria margaritifera (ncbitaxon:748017)
- PubMed (21751786) Extracted with CHCl2/MeOH (2:1) Strain: NAC8 46
- PubMed (21751786) Extracted with CHCl2/MeOH (2:1) Strain: NAC8 45
Oscillatoria margaritifera NAC8-55 (ncbitaxon:748040) - PubMed (21751786) Extracted with CHCl2/MeOH (2:1)
Oscillatoria margaritifera NAC8-54 (ncbitaxon:748039) - PubMed (21751786) Extracted with CHCl2/MeOH (2:1)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
tumonoic acid B (CHEBI:69208) has role metabolite (CHEBI:25212)
tumonoic acid B (CHEBI:69208) is a depsipeptide (CHEBI:23643)
Synonym  Source
(2S)-2-[(2R,3S)-2-[(2S)-1-[(E,2R,3S)-3-hydroxy-2,4-dimethyldodec-4-enoyl]pyrrolidine-2-carbonyl]oxy-3-methylpentanoyl]oxypropanoic acidChEBI
Citations