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CHEBI:211093 - Asterriquinone I

ChEBI IDCHEBI:211093
ChEBI NameAsterriquinone I
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FormulaC34H34N2O5
Net Charge0
Average Mass550.655
Monoisotopic Mass550.24677
SMILESC=CC(C)(C)c1nc2ccccc2c1C1=C(OC)C(=O)C(c2cnc3c(C[C@@H](O)C(=C)C)cccc23)=C(OC)C1=O
InChIInChI=1S/C34H34N2O5/c1-8-34(4,5)33-25(21-13-9-10-15-23(21)36-33)27-30(39)31(40-6)26(29(38)32(27)41-7)22-17-35-28-19(12-11-14-20(22)28)16-24(37)18(2)3/h8-15,17,24,35-37H,1-2,16H2,3-7H3/t24-/m1/s1
InChIKeyBAWTWEKDFKBXFA-XMMPIXPASA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1039/c9qo00351g)
ChEBI Ontology
Outgoing Relation(s)
Asterriquinone I (CHEBI:211093) is a prenylquinone (CHEBI:26255)
IUPAC Name 
2-[7-[(2R)-2-hydroxy-3-methylbut-3-enyl]-1H-indol-3-yl]-3,6-dimethoxy-5-[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]cyclohexa-2,5-diene-1,4-dione
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