CHEBI:68741 - chetomin

ChEBI IDCHEBI:68741
ChEBI Namechetomin
Stars
DefinitionAn organic heteropentacyclic compound of the class of epipolythiodioxopiperazine. Isolated from Chaetomium globosum and Farrowia seminuda, it exhibits immunosuppressive activity.
Last Modified8 November 2024
DownloadsMolfile
FormulaC31H30N6O6S4
Net Charge0
Average Mass710.885
Monoisotopic Mass710.11097
SMILESCN1C(=O)C2(Cc3cn(C45CC67SSC(CO)(C(=O)N6C4Nc4ccccc45)N(C)C7=O)c4ccccc34)SSC1(CO)C(=O)N2C
InChIInChI=1S/C31H30N6O6S4/c1-33-25(42)30(15-38)34(2)23(40)28(33,44-46-30)12-17-13-36(21-11-7-4-8-18(17)21)27-14-29-24(41)35(3)31(16-39,47-45-29)26(43)37(29)22(27)32-20-10-6-5-9-19(20)27/h4-11,13,22,32,38-39H,12,14-16H2,1-3H3
InChIKeyZRZWBWPDBOVIGQ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Chaetomium globosum (ncbitaxon:38033) - PubMed (5066072)
Farrowia seminuda (ncbitaxon:110149) - PubMed (14738397)
Roles Classification
Biological Roles:
Chaetomium metabolite  Any fungal metabolite produced during a metabolic reaction in the mould, Chaetomium.
immunosuppressive agent  An agent that suppresses immune function by one of several mechanisms of action. Classical cytotoxic immunosuppressants act by inhibiting DNA synthesis. Others may act through activation of T-cells or by inhibiting the activation of helper cells. In addition, an immunosuppressive agent is a role played by a compound which is exhibited by a capability to diminish the extent and/or voracity of an immune response.
Application:
immunosuppressive agent  An agent that suppresses immune function by one of several mechanisms of action. Classical cytotoxic immunosuppressants act by inhibiting DNA synthesis. Others may act through activation of T-cells or by inhibiting the activation of helper cells. In addition, an immunosuppressive agent is a role played by a compound which is exhibited by a capability to diminish the extent and/or voracity of an immune response.
ChEBI Ontology
Outgoing Relation(s)
chetomin (CHEBI:68741) has role Chaetomium metabolite (CHEBI:76960)
chetomin (CHEBI:68741) has role immunosuppressive agent (CHEBI:35705)
chetomin (CHEBI:68741) is a indoles (CHEBI:24828)
chetomin (CHEBI:68741) is a organic disulfide (CHEBI:35489)
chetomin (CHEBI:68741) is a organic heteropentacyclic compound (CHEBI:38164)
IUPAC Name 
3-(hydroxymethyl)-10b-(3-{[4-(hydroxymethyl)-5,7-dimethyl-6,8-dioxo-2,3-dithia-5,7-diazabicyclo[2.2.2]oct-1-yl]methyl}-1H-indol-1-yl)-2-methyl-2,3,5a,6,10b,11-hexahydro-3,11a-epidithiopyrazino[1',2':1,5]pyrrolo[2,3-b]indole-1,4-dione
Manual XrefsDatabases
2592ChemSpider
Registry NumbersSources
Reaxys:5722511Reaxys
CAS:1403-36-7ChemIDplus
Citations