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CHEBI:67330 - Veraguamide A

ChEBI IDCHEBI:67330
ChEBI NameVeraguamide A
Stars
DefinitionA natural product found in Symploca hydnoides and Oscillatoria margaritifera PAC-17-FEB-10-2.
Last Modified22 September 2014
DownloadsMolfile
FormulaC37H59BrN4O8
Net Charge0
Average Mass767.803
Monoisotopic Mass766.35163
SMILESCC[C@H](C)[C@@H]1OC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@@H](C)[C@@H](CCCC#CBr)OC(=O)[C@H](C(C)C)N(C)C(=O)[C@@H]2CCCN2C1=O
InChIInChI=1S/C37H59BrN4O8/c1-12-24(8)31-35(46)42-20-16-17-26(42)33(44)40(10)29(22(4)5)36(47)49-27(18-14-13-15-19-38)25(9)32(43)39-28(21(2)3)34(45)41(11)30(23(6)7)37(48)50-31/h21-31H,12-14,16-18,20H2,1-11H3,(H,39,43)/t24-,25-,26-,27+,28-,29-,30-,31-/m0/s1
InChIKeyWWYBIFCBAWCPFI-AVCHBABLSA-N
Species of MetaboliteComponentSourceComments
Oscillatoria margaritifera PAC-17-FEB-10-2 (ncbitaxon:991921) - PubMed (21488639) CH2Cl2:CH3OH(2:1) extract of biomass
Symploca hydnoides (ncbitaxon:207924) - PubMed (21446699) EtOAc-MeOH(1:1) extract of freeze-dried cyanobacteria
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)
Veraguamide A (CHEBI:67330) has role metabolite (CHEBI:25212)
Veraguamide A (CHEBI:67330) is a cyclodepsipeptide (CHEBI:35213)
Citations