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CHEBI:216930 - Dysidphenol A

ChEBI IDCHEBI:216930
ChEBI NameDysidphenol A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H32O4
Net Charge0
Average Mass372.505
Monoisotopic Mass372.23006
SMILESCOC(=O)c1cc(O)c2c(c1)C[C@@]1(O2)[C@@H](C)CC[C@@H]2C(C)(C)CCC[C@]21C
InChIInChI=1S/C23H32O4/c1-14-7-8-18-21(2,3)9-6-10-22(18,4)23(14)13-16-11-15(20(25)26-5)12-17(24)19(16)27-23/h11-12,14,18,24H,6-10,13H2,1-5H3/t14-,18+,22+,23+/m0/s1
InChIKeyDEEMHJXPOBTJEP-LAHPKLRZSA-N
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (27109501)
ChEBI Ontology
Outgoing Relation(s)
Dysidphenol A (CHEBI:216930) is a benzofurans (CHEBI:35259)
IUPAC Name 
methyl (4aR,7S,8R,8aR)-7'-hydroxy-4,4,7,8a-tetramethylspiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3H-1-benzouran]-5'-carboxylate
Manual XrefsDatabases
58197112ChemSpider