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CHEBI:228098 - Pallidopenilline F

ChEBI IDCHEBI:228098
ChEBI NamePallidopenilline F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H28O6
Net Charge0
Average Mass328.405
Monoisotopic Mass328.18859
SMILESCC(=O)OCCC(=O)[C@@H]1[C@H]2CC[C@H](C)C[C@@H]2[C@H](O)[C@@H](O)[C@@]1(C)O
InChIInChI=1S/C17H28O6/c1-9-4-5-11-12(8-9)15(20)16(21)17(3,22)14(11)13(19)6-7-23-10(2)18/h9,11-12,14-16,20-22H,4-8H2,1-3H3/t9-,11-,12-,14-,15-,16+,17-/m0/s1
InChIKeyFVWHCISSWMJCBI-YSOYJNHBSA-N
Species of MetaboliteComponentSourceComments
Penicillium thomii (ncbitaxon:36647) - PubMed (28006908)
ChEBI Ontology
Outgoing Relation(s)
Pallidopenilline F (CHEBI:228098) is a cyclitol (CHEBI:23451)
IUPAC Name 
[3-[(1R,2S,3R,4S,4aS,6S,8aS)-2,3,4-trihydroxy-2,6-dimethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-naphthalen-1-yl]-3-oxopropyl] acetate
Manual XrefsDatabases
60596908ChemSpider