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CHEBI:225186 - Hamigerone

ChEBI IDCHEBI:225186
ChEBI NameHamigerone
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SubmitterMetaboLights
DownloadsMolfile
FormulaC25H32O5
Net Charge0
Average Mass412.526
Monoisotopic Mass412.22497
SMILESCC(=O)CC1=C(C)C=C2CC(C)C(=O)C(C)C2C1/C=C(\C)C1OC1(C)/C=C/C(=O)O
InChIInChI=1S/C25H32O5/c1-13-9-18-10-14(2)23(29)17(5)22(18)20(19(13)12-16(4)26)11-15(3)24-25(6,30-24)8-7-21(27)28/h7-9,11,14,17,20,22,24H,10,12H2,1-6H3,(H,27,28)/b8-7+,15-11+
InChIKeyJXLMEPREHWJPBB-XHBXSBNISA-N
Species of MetaboliteComponentSourceComments
Hamigera avellanea (ncbitaxon:39317) - DOI (10.3891/acta.chem.scand.51-1241)
ChEBI Ontology
Outgoing Relation(s)
Hamigerone (CHEBI:225186) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
(E)-3-[2-methyl-3-[(E)-1-[3,6,8-trimethyl-7-oxo-2-(2-oxopropyl)-5,6,8,8a-tetrahydro-1H-naphthalen-1-yl]prop-1-en-2-yl]oxiran-2-yl]prop-2-enoic acid
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78444967ChemSpider