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CHEBI:68739 - prochaetoglobosin I

ChEBI IDCHEBI:68739
ChEBI Nameprochaetoglobosin I
Stars
DefinitionA cytochalasan alkaloid found in Chaetomium globosum and Chaetomium subaffine.
Last Modified29 October 2013
DownloadsMolfile
FormulaC32H38N2O2
Net Charge0
Average Mass482.668
Monoisotopic Mass482.29333
SMILES[H][C@]12[C@H](Cc3cnc4ccccc34)NC(=O)[C@]13C(=O)/C=C\CC/C(C)=C/[C@@H](C)C/C=C/[C@H]3C=C(C)[C@H]2C
InChIInChI=1S/C32H38N2O2/c1-20-10-5-8-15-29(35)32-25(12-9-11-21(2)16-20)17-22(3)23(4)30(32)28(34-31(32)36)18-24-19-33-27-14-7-6-13-26(24)27/h6-9,12-17,19,21,23,25,28,30,33H,5,10-11,18H2,1-4H3,(H,34,36)/b12-9+,15-8-,20-16+/t21-,23+,25-,28-,30-,32+/m0/s1
InChIKeyPAFRQNXHHHYHMF-YOJZVGJQSA-N
Species of MetaboliteComponentSourceComments
Chaetomium subaffine (ncbitaxon:1036253) - CiteXplore (c6151)
Chaetomium globosum (ncbitaxon:38033) - PubMed (15497948)
Roles Classification
Biological Roles:
Chaetomium metabolite  Any fungal metabolite produced during a metabolic reaction in the mould, Chaetomium.
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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)
prochaetoglobosin I (CHEBI:68739) has role Chaetomium metabolite (CHEBI:76960)
prochaetoglobosin I (CHEBI:68739) is a cytochalasan alkaloid (CHEBI:75946)
prochaetoglobosin I (CHEBI:68739) is a indoles (CHEBI:24828)
prochaetoglobosin I (CHEBI:68739) is a macrocycle (CHEBI:51026)
IUPAC Name 
(3S,3aR,4S,6aS,7E,10S,11E,15Z,17aS)-3-(1H-indol-3-ylmethyl)-4,5,10,12-tetramethyl-3,3a,4,6a,9,10,13,14-octahydro-1H-cyclotrideca[d]isoindole-1,17(2H)-dione
Manual XrefsDatabases
9446643ChemSpider
Registry NumbersSources
Reaxys:4831106Reaxys
Citations