CHEBI:145682 - 6-hydroxydeoxybrevianamide E

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 6-hydroxydeoxybrevianamide E
ChEBI ID CHEBI:145682
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C21H25N3O3
Net Charge 0
Average Mass 367.449
Monoisotopic Mass 367.18959
InChI InChI=1S/C21H25N3O3/c1-4-21(2,3)18-14(13-8-7-12(25)10-15(13)22-18)11-16-20(27)24-9-5-6-17(24)19(26)23-16/h4,7-8,10,16-17,22,25H,1,5-6,9,11H2,2-3H3,(H,23,26)/t16-,17-/m0/s1
InChIKey DHOZDQLRUFUUQZ-IRXDYDNUSA-N
SMILES N12C([C@@H](NC([C@@]1(CCC2)[H])=O)CC3=C(NC4=C3C=CC(=C4)O)C(C=C)(C)C)=O
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.
(via alkaloid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 6-hydroxydeoxybrevianamide E (CHEBI:145682) is a dipeptide (CHEBI:46761)
6-hydroxydeoxybrevianamide E (CHEBI:145682) is a indole alkaloid (CHEBI:38958)
6-hydroxydeoxybrevianamide E (CHEBI:145682) is a indoles (CHEBI:24828)
6-hydroxydeoxybrevianamide E (CHEBI:145682) is a pyrrolopyrazine (CHEBI:48337)
Synonym Source
6-hydroxydeoxybrevianamide E UniProt
Citations Waiting for Citations Types Sources
20722388 PubMed citation SUBMITTER
22140281 PubMed citation SUBMITTER