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CHEBI:152056 - cladofulvin

ChEBI IDCHEBI:152056
ChEBI Namecladofulvin
Stars
DefinitionA bianthracene homodimer composed of two nataloe-emodin moieties linked by an aryl-aryl bond. It is a secondary metabolite isolated from the fungal tomato pathogen Cladosporium fulvum.
Last Modified3 June 2020
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC30H18O10
Net Charge0
Average Mass538.464
Monoisotopic Mass538.09000
SMILESCc1cc2c(c(O)c1-c1c(C)cc(O)c3c1C(=O)c1ccc(O)c(O)c1C3=O)C(=O)c1c(ccc(O)c1O)C2=O
InChIInChI=1S/C30H18O10/c1-9-7-13-21(29(39)19-11(24(13)34)3-5-14(31)26(19)36)28(38)18(9)17-10(2)8-16(33)22-23(17)25(35)12-4-6-15(32)27(37)20(12)30(22)40/h3-8,31-33,36-38H,1-2H3
InChIKeyXHKQDFVQROFUEL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Cladosporium fulvum (ncbitaxon:5499) cell suspension culture (BTO:0000221) PubMed (24465762)
Roles Classification
Biological Roles:
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
biological pigment  An endogenous molecular entity that results in a colour of an organism as the consequence of the selective absorption of light.
ChEBI Ontology
Outgoing Relation(s)
cladofulvin (CHEBI:152056) has functional parent nataloe-emodin (CHEBI:152054)
cladofulvin (CHEBI:152056) has role biological pigment (CHEBI:26130)
cladofulvin (CHEBI:152056) has role fungal metabolite (CHEBI:76946)
cladofulvin (CHEBI:152056) is a bianthracenes (CHEBI:145988)
cladofulvin (CHEBI:152056) is a polyphenol (CHEBI:26195)
cladofulvin (CHEBI:152056) is a trihydroxyanthraquinone (CHEBI:37488)
cladofulvin (CHEBI:152056) is conjugate acid of cladofulvin(2−) (CHEBI:152057)
Incoming Relation(s)
cladofulvin(2−) (CHEBI:152057) is conjugate base of cladofulvin (CHEBI:152056)
IUPAC Name 
1',4,5,6,7',8'-hexahydroxy-2,3'-dimethyl[1,2'-bianthracene]-9,9',10,10'-tetrone
Registry NumbersSources
CAS:11032-85-2ChEBI
Citations