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CHEBI:209743 - Cytosporin O

ChEBI IDCHEBI:209743
ChEBI NameCytosporin O
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H32O5
Net Charge0
Average Mass340.460
Monoisotopic Mass340.22497
SMILESCCCCCC=CC1=C(CO)[C@H]2OC(C)(C)[C@H](O)C[C@@]2(O)C[C@@H]1O
InChIInChI=1S/C19H32O5/c1-4-5-6-7-8-9-13-14(12-20)17-19(23,10-15(13)21)11-16(22)18(2,3)24-17/h8-9,15-17,20-23H,4-7,10-12H2,1-3H3/t15-,16+,17+,19-/m0/s1
InChIKeyQHVWABKEGKWMSX-FAJBIJEISA-N
Species of MetaboliteComponentSourceComments
Pseudopestalotiopsis theae (ncbitaxon:218556) - PubMed (32102178)
ChEBI Ontology
Outgoing Relation(s)
Cytosporin O (CHEBI:209743) is a benzopyran (CHEBI:22727)
IUPAC Name 
(3R,4aS,6S,8aR)-7-hept-1-enyl-8-(hydroxymethyl)-2,2-dimethyl-4,5,6,8a-tetrahydro-3H-chromene-3,4a,6-triol