EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:80955 - eudistomin C

Default Structure
ChEBI IDCHEBI:80955
ChEBI Nameeudistomin C
Stars
DefinitionAn organic heterotetracyclic compound that has formula C14H16BrN3O2S. It is a natural product isolated from the Caribbean tunicate Eudistoma olivaceum and exhibits potent anti-tumor and antiviral activities.
Last Modified12 October 2021
DownloadsMolfile
FormulaC14H16BrN3O2S
Net Charge0
Average Mass370.272
Monoisotopic Mass369.01466
SMILES[H][C@]12c3nc4cc(Br)c(O)cc4c3CCN1OCSC[C@H]2N
InChIInChI=1S/C14H16BrN3O2S/c15-9-4-11-8(3-12(9)19)7-1-2-18-14(13(7)17-11)10(16)5-21-6-20-18/h3-4,10,14,17,19H,1-2,5-6,16H2/t10-,14+/m1/s1
InChIKeyXHYJPORPMFTSBP-YGRLFVJLSA-N
Species of MetaboliteComponentSourceComments
Eudistoma olivaceum (ncbitaxon:1331021) - DOI (10.1021/ja00317a079)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
antiviral agent  A substance that destroys or inhibits replication of viruses.
marine metabolite  Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
protein synthesis inhibitor  A compound, usually an anti-bacterial agent or a toxin, which inhibits the synthesis of a protein.
animal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
eudistomin C (CHEBI:80955) has role animal metabolite (CHEBI:75767)
eudistomin C (CHEBI:80955) has role antineoplastic agent (CHEBI:35610)
eudistomin C (CHEBI:80955) has role antiviral agent (CHEBI:22587)
eudistomin C (CHEBI:80955) has role marine metabolite (CHEBI:76507)
eudistomin C (CHEBI:80955) has role protein synthesis inhibitor (CHEBI:48001)
eudistomin C (CHEBI:80955) is a indole alkaloid (CHEBI:38958)
eudistomin C (CHEBI:80955) is a organic heterotetracyclic compound (CHEBI:38163)
eudistomin C (CHEBI:80955) is a organobromine compound (CHEBI:37141)
eudistomin C (CHEBI:80955) is a phenols (CHEBI:33853)
eudistomin C (CHEBI:80955) is a primary amino compound (CHEBI:50994)
IUPAC Name 
(1S,13bS)-1-amino-11-bromo-1,2,7,8,13,13b-hexahydro[1,6,2]oxathiazepino[2',3':1,2]pyrido[3,4-b]indol-10-ol
Synonyms  Source
(−)-eudistomin CChEBI
(−)-eudistomine CChEBI
eudistomine CChemIDplus
Manual XrefsDatabases
160734ChemSpider
C17167KEGG COMPOUND
Registry NumbersSources
CAS:88704-50-1ChemIDplus
Citations