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CHEBI:205888 - Viburspiran

ChEBI IDCHEBI:205888
ChEBI NameViburspiran
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H26O7
Net Charge0
Average Mass378.421
Monoisotopic Mass378.16785
SMILESCCCCC[C@@H]1[C@H]2C(=O)OC(=O)[C@@]23CCC12C(=O)OC(=O)[C@@H]2C[C@H](C)[C@H]3O
InChIInChI=1S/C20H26O7/c1-3-4-5-6-11-13-16(23)27-18(25)20(13)8-7-19(11)12(9-10(2)14(20)21)15(22)26-17(19)24/h10-14,21H,3-9H2,1-2H3/t10-,11+,12-,13-,14+,19?,20-/m0/s1
InChIKeyGHDBWAUSVJFFHH-CNIPVTSVSA-N
Species of MetaboliteComponentSourceComments
Cryptosporiopsis (ncbitaxon:108533) - DOI (10.1002/ejoc.201001324)
ChEBI Ontology
Outgoing Relation(s)
Viburspiran (CHEBI:205888) has functional parent tetracarboxylic acid (CHEBI:35742)
Viburspiran (CHEBI:205888) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(1S,2R,3S,5R,10R,11R)-2-hydroxy-3-methyl-10-pentyl-7,13-dioxatetracyclo[7.5.2.01,11.05,9]hexadecane-6,8,12,14-tetrone
Manual XrefsDatabases
78442611ChemSpider