CHEBI:69834 - subereamine A

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ChEBI Name subereamine A
ChEBI ID CHEBI:69834
Definition A natural product found in Suberea mollis.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C16H21BrN4O4
Net Charge 0
Average Mass 413.26600
Monoisotopic Mass 412.07462
InChI InChI=1S/C16H21BrN4O4/c1-25-13-6-4-10(9-11(13)17)5-7-14(22)21-12(15(23)24)3-2-8-20-16(18)19/h4-7,9,12H,2-3,8H2,1H3,(H,21,22)(H,23,24)(H4,18,19,20)/b7-5+/t12-/m1/s1
InChIKey CYWJABQUHPIUCD-HOSRBBHYSA-N
SMILES COc1ccc(\C=C\C(=O)N[C@H](CCCNC(N)=N)C(O)=O)cc1Br
Metabolite of Species Details
Suberea mollis (WORMS:169627) EtOH extract of frozen sponge See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing subereamine A (CHEBI:69834) has role metabolite (CHEBI:25212)
subereamine A (CHEBI:69834) is a N-acyl-amino acid (CHEBI:51569)
Synonyms Sources
(E)-2-(3-(3-bromo-4-methoxyphenyl)acrylamido)-5-guanidinopentanoic acid ChEBI
N2-[(2E)-3-(3-Bromo-4-methoxyphenyl)-2-propenoyl]-D-arginine ChEBI
Citation Waiting for Citations Type Source
21542602 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:cinnamamides(CHEBI:23247); ISA:alpha-amino acid(CHEBI:33704); ISA:olefinic compound(CHEBI:78840); ISA:styrenes(CHEBI:26799); ISA:methoxybenzene(CHEBI:51683); ISA:amino fatty acid(CHEBI:59650); ISA:aromatic ether(CHEBI:35618); ISA:organobromine compound(CHEBI:37141); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:guanidines(CHEBI:24436); ISA:carboxamide(CHEBI:37622); ISA:organonitrogen compound(CHEBI:35352); ISA:organic heterocyclic compound(CHEBI:24532); ISA:monocarboxylic acid(CHEBI:25384); ISA:carboxylic acid(CHEBI:33575); ISA:amine(CHEBI:32952); ISA:carbonyl compound(CHEBI:36586); ISA:imine(CHEBI:24783);