CHEBI:67330 - Veraguamide A

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ChEBI Name Veraguamide A
ChEBI ID CHEBI:67330
Definition A natural product found in Symploca hydnoides and Oscillatoria margaritifera PAC-17-FEB-10-2.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C37H59BrN4O8
Net Charge 0
Average Mass 767.79000
Monoisotopic Mass 766.352
InChI InChI=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
InChIKey WWYBIFCBAWCPFI-AVCHBABLSA-N
SMILES CC[C@H](C)[C@@H]1OC(=O)[C@H](C(C)C)N(C)C(=O)[C@@H](NC(=O)[C@@H](C)[C@@H](CCCC#CBr)OC(=O)[C@H](C(C)C)N(C)C(=O)[C@@H]2CCCN2C1=O)C(C)C
Metabolite of Species Details
Symploca hydnoides (NCBI:txid207924) EtOAc-MeOH(1:1) extract of freeze-dried cyanobacteria See: PubMed
Oscillatoria margaritifera PAC-17-FEB-10-2 (NCBI:txid991921) CH2Cl2:CH3OH(2:1) extract of biomass See: PubMed
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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ChEBI Ontology
Outgoing Veraguamide A (CHEBI:67330) has role metabolite (CHEBI:25212)
Veraguamide A (CHEBI:67330) is a cyclodepsipeptide (CHEBI:35213)
Citations Waiting for Citations Types Sources
21446699 PubMed citation Europe PMC
21488639 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:macrolide(CHEBI:25106); ISA:lactam(CHEBI:24995); ISA:alpha-amino acid ester(CHEBI:46874); ISA:keratan 6'-sulfate(CHEBI:18331); ISA:azamacrocycle(CHEBI:52898); ISA:dicarboxylic acid(CHEBI:35692); ISA:pyrrolidines(CHEBI:38260); ISA:carboxamide(CHEBI:37622); ISA:lactone(CHEBI:25000); ISA:tertiary amine(CHEBI:32876); ISA:carboxylic ester(CHEBI:33308); ISA:carboxylic acid(CHEBI:33575); ISA:ether(CHEBI:25698); ISA:carbonyl compound(CHEBI:36586); ISA:organobromine compound(CHEBI:37141);