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CHEBI:202815 - 2-O-acetylaltersolanol L

ChEBI IDCHEBI:202815
ChEBI Name2-O-acetylaltersolanol L
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H22O8
Net Charge0
Average Mass366.366
Monoisotopic Mass366.13147
SMILESCOc1cc(O)c2c(c1)[C@H](O)[C@@H]1[C@H](C[C@@H](OC(C)=O)[C@@](C)(O)[C@@H]1O)C2=O
InChIInChI=1S/C18H22O8/c1-7(19)26-12-6-10-14(17(23)18(12,2)24)16(22)9-4-8(25-3)5-11(20)13(9)15(10)21/h4-5,10,12,14,16-17,20,22-24H,6H2,1-3H3/t10-,12+,14-,16-,17+,18+/m0/s1
InChIKeyJOCYAISYJVQQMF-LGYFHBSQSA-N
Species of MetaboliteComponentSourceComments
Stemphyliumspecies 33231 (ncbitaxon:1418481) - PubMed (25136754)
ChEBI Ontology
Outgoing Relation(s)
2-O-acetylaltersolanol L (CHEBI:202815) is a anthracenes (CHEBI:46955)
IUPAC Name 
[(2R,3S,4R,4aS,9aS,10R)-3,4,8,10-tetrahydroxy-6-methoxy-3-methyl-9-oxo-1,2,4,4a,9a,10-hexahydroanthracen-2-yl] acetate
Manual XrefsDatabases
34981987ChemSpider