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CHEBI:205762 - Ascotrichol A

ChEBI IDCHEBI:205762
ChEBI NameAscotrichol A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC12H14O5
Net Charge0
Average Mass238.239
Monoisotopic Mass238.08412
SMILESC[C@@H](O)C[C@H]1OC(=O)c2c(O)cccc2[C@@H]1O
InChIInChI=1S/C12H14O5/c1-6(13)5-9-11(15)7-3-2-4-8(14)10(7)12(16)17-9/h2-4,6,9,11,13-15H,5H2,1H3/t6-,9-,11+/m1/s1
InChIKeyOZPPUNAJNKTRIL-CGYDSVCVSA-N
Species of MetaboliteComponentSourceComments
Ascotrichaspecies ZJ-M-5 (ncbitaxon:1217164) - PubMed (29781301)
ChEBI Ontology
Outgoing Relation(s)
Ascotrichol A (CHEBI:205762) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
(3R,4S)-4,8-dihydroxy-3-[(2R)-2-hydroxypropyl]-3,4-dihydroisochromen-1-one