EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:69033 - Talathermophilins B

ChEBI IDCHEBI:69033
ChEBI NameTalathermophilins B
Stars
DefinitionA natural product found in Talaromyces thermophilus and Talaromyces thermophilus.
Last Modified22 September 2014
DownloadsMolfile
FormulaC24H27N3O3
Net Charge0
Average Mass405.498
Monoisotopic Mass405.20524
SMILESC=CC(C)(C)c1nc2c3c(ccc2c1/C=C1\NC(=O)[C@H](C)NC1=O)OC(C)(C)C=C3
InChIInChI=1S/C24H27N3O3/c1-7-23(3,4)20-16(12-17-22(29)25-13(2)21(28)26-17)14-8-9-18-15(19(14)27-20)10-11-24(5,6)30-18/h7-13,27H,1H2,2-6H3,(H,25,29)(H,26,28)/b17-12-/t13-/m0/s1
InChIKeyWTWFASVQVSRLOB-IGWPVBGESA-N
Species of MetaboliteComponentSourceComments
Talaromyces thermophilus (ncbitaxon:28565)
- PubMed (21967034) Strain: YM3 4
- PubMed (21967034) Strain: YM1 3
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Talathermophilins B (CHEBI:69033) has role metabolite (CHEBI:25212)
Talathermophilins B (CHEBI:69033) is a 1-benzopyran (CHEBI:38443)
Synonym  Source
(3Z,6S)-3-[[7,7-dimethyl-2-(2-methylbut-3-en-2-yl)-1H-pyrano[2,3-g]indol-3-yl]methylidene]-6-methylpiperazine-2,5-dioneChEBI
Citations