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CHEBI:67618 - 12β-hydroxychaetoviridin C

ChEBI IDCHEBI:67618
ChEBI Name12β-hydroxychaetoviridin C
Stars
ASCII Name12beta-hydroxychaetoviridin C
DefinitionAn azaphilone that is the 12β-hydroxy derivative of chaetoviridin C. It has been isolated from Chaetomium globosum.
Last Modified15 October 2013
DownloadsMolfile
FormulaC23H27ClO7
Net Charge0
Average Mass450.915
Monoisotopic Mass450.14453
SMILES[H][C@]12C3=COC(/C=C/[C@@H](C)[C@@H](C)O)=CC3=C(Cl)C(=O)[C@@]1(C)OC(=O)[C@H]2C(=O)[C@@H](C)[C@H](C)O
InChIInChI=1S/C23H27ClO7/c1-10(12(3)25)6-7-14-8-15-16(9-30-14)18-17(20(27)11(2)13(4)26)22(29)31-23(18,5)21(28)19(15)24/h6-13,17-18,25-26H,1-5H3/b7-6+/t10-,11+,12-,13+,17-,18-,23+/m1/s1
InChIKeyMEPQPODJTXSHEP-HETSEVKPSA-N
Species of MetaboliteComponentSourceComments
Chaetomium globosum (ncbitaxon:38033)
mycelium (BTO:0001436) PubMed (21548578) Endophytic fungus in leaves of Viguiera robusta, EtOAc extract of culture broth and mycelium
- PubMed (21548578)
Roles Classification
Biological Role:
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
ChEBI Ontology
Outgoing Relation(s)
12β-hydroxychaetoviridin C (CHEBI:67618) has functional parent chaetoviridin C (CHEBI:68743)
12β-hydroxychaetoviridin C (CHEBI:67618) is a azaphilone (CHEBI:50941)
12β-hydroxychaetoviridin C (CHEBI:67618) is a enone (CHEBI:51689)
12β-hydroxychaetoviridin C (CHEBI:67618) is a organic heterotricyclic compound (CHEBI:26979)
12β-hydroxychaetoviridin C (CHEBI:67618) is a organochlorine compound (CHEBI:36683)
12β-hydroxychaetoviridin C (CHEBI:67618) is a secondary alcohol (CHEBI:35681)
12β-hydroxychaetoviridin C (CHEBI:67618) is a β-hydroxy ketone (CHEBI:55380)
12β-hydroxychaetoviridin C (CHEBI:67618) is a γ-lactone (CHEBI:37581)
IUPAC Name 
rel-(6aS,9R,9aS)-5-chloro-9-[(2S,3S)-3-hydroxy-2-methylbutanoyl]-3-[(1E,3R,4R)-4-hydroxy-3-methylpent-1-en-1-yl]-6a-methyl-9,9a-dihydro-6H-furo[2,3-h]isochromene-6,8(6aH)-dione
Registry NumbersSources
Reaxys:21577529Reaxys
Citations