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CHEBI:211629 - Alokicenone G

ChEBI IDCHEBI:211629
ChEBI NameAlokicenone G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H24O8
Net Charge0
Average Mass416.426
Monoisotopic Mass416.14712
SMILESCCOC(=O)[C@H](Cc1c(O)cc(C)c2c(O)c3c(cc12)[C@@H](O)CCC3=O)C(=O)OC
InChIInChI=1S/C22H24O8/c1-4-30-22(28)14(21(27)29-3)8-11-12-9-13-15(23)5-6-16(24)19(13)20(26)18(12)10(2)7-17(11)25/h7,9,14-15,23,25-26H,4-6,8H2,1-3H3/t14-,15+/m1/s1
InChIKeyJWHVHOHFMSBJIG-CABCVRRESA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - DOI (10.1016/j.tet.2018.09.049)
ChEBI Ontology
Outgoing Relation(s)
Alokicenone G (CHEBI:211629) is a anthracenes (CHEBI:46955)
IUPAC Name 
1-O-ethyl 3-O-methyl (2R)-2-[[(8S)-2,8,10-trihydroxy-4-methyl-5-oxo-7,8-dihydro-6H-anthracen-1-yl]methyl]propanedioate
Manual XrefsDatabases
71048812ChemSpider