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CHEBI:210345 - Tricycloalterfurene F

ChEBI IDCHEBI:210345
ChEBI NameTricycloalterfurene F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H30O6
Net Charge0
Average Mass378.465
Monoisotopic Mass378.20424
SMILESCC(=C[C@H]1C[C@@]2(C)OC3=C(C[C@H]2O1)C(=O)[C@H](O)CC3)CCCC(C)C(=O)O
InChIInChI=1S/C21H30O6/c1-12(5-4-6-13(2)20(24)25)9-14-11-21(3)18(26-14)10-15-17(27-21)8-7-16(22)19(15)23/h9,13-14,16,18,22H,4-8,10-11H2,1-3H3,(H,24,25)/t13?,14-,16+,18+,21+/m0/s1
InChIKeyPALQGDVLLVRPAA-LDFGHMCQSA-N
Species of MetaboliteComponentSourceComments
Stemphyliumspecies FJJ006 (ncbitaxon:1874986) - PubMed (32825785)
ChEBI Ontology
Outgoing Relation(s)
Tricycloalterfurene F (CHEBI:210345) is a furopyran (CHEBI:74927)
IUPAC Name 
7-[(2R,3aR,7R,9aR)-7-hydroxy-3a-methyl-8-oxo-3,5,6,7,9,9a-hexahydro-2H-uro[3,2-b]chromen-2-yl]-2,6-dimethylhept-6-enoic acid