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CHEBI:212613 - Mabetaarinin B

ChEBI IDCHEBI:212613
ChEBI NameMabetaarinin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H20O5
Net Charge0
Average Mass340.375
Monoisotopic Mass340.13107
SMILESC[C@H]1CC(=O)c2c(coc2-c2c(O)ccc3c2OC(C)(C)C=C3)[C@@H]1O
InChIInChI=1S/C20H20O5/c1-10-8-14(22)15-12(17(10)23)9-24-19(15)16-13(21)5-4-11-6-7-20(2,3)25-18(11)16/h4-7,9-10,17,21,23H,8H2,1-3H3/t10-,17+/m0/s1
InChIKeySRUGXOLNOMJETJ-DYZYQPBXSA-N
Species of MetaboliteComponentSourceComments
Massarina (ncbitaxon:45292) - PubMed (12542349)
ChEBI Ontology
Outgoing Relation(s)
Mabetaarinin B (CHEBI:212613) is a 1-benzopyran (CHEBI:38443)
IUPAC Name 
(6S,7R)-7-hydroxy-3-(7-hydroxy-2,2-dimethylchromen-8-yl)-6-methyl-6,7-dihydro-5H-2-benzouran-4-one
Manual XrefsDatabases
8558048ChemSpider