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CHEBI:209398 - Ganoboninone F

ChEBI IDCHEBI:209398
ChEBI NameGanoboninone F
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SubmitterMetaboLights
DownloadsMolfile
FormulaC31H44O7
Net Charge0
Average Mass528.686
Monoisotopic Mass528.30870
SMILESC=C(C)[C@@H]1C[C@H](OC(C)=O)C2=C(C(=O)C[C@]34CO[C@@](C)(CCC(=O)CC)[C@H]3CC[C@@]24C)[C@@]1(C)CCC(=O)O
InChIInChI=1S/C31H44O7/c1-8-20(33)9-14-30(7)24-10-13-29(6)27-23(38-19(4)32)15-21(18(2)3)28(5,12-11-25(35)36)26(27)22(34)16-31(24,29)17-37-30/h21,23-24H,2,8-17H2,1,3-7H3,(H,35,36)/t21-,23-,24+,28-,29-,30-,31-/m0/s1
InChIKeyDCXSLOVKLLXMQB-KZSFNMNISA-N
Species of MetaboliteComponentSourceComments
Ganoderma boninense (ncbitaxon:34458) - DOI (10.1016/j.tet.2015.02.002)
ChEBI Ontology
Outgoing Relation(s)
Ganoboninone F (CHEBI:209398) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
3-[(1S,5S,6S,8S,10R,13S,14S)-8-acetyloxy-5,10,14-trimethyl-3-oxo-14-(3-oxopentyl)-6-prop-1-en-2-yl-15-oxatetracyclo[8.6.0.01,13.04,9]hexadec-4(9)-en-5-yl]propanoic acid
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78438472ChemSpider