Boletinin J (CHEBI:202666)

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CHEBI:202666 - Boletinin J

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ChEBI ID	CHEBI:202666
ChEBI Name	Boletinin J
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Submitter	MetaboLights
Downloads	Molfile

Formula	C25H36O6
Net Charge	0
Average Mass	432.557
Monoisotopic Mass	432.25119
SMILES	C/C(=C\CC/C(C)=C/COC(=O)/C(C)=C/C(=O)O)CC/C=C(\C)CC/C=C(\C)C(=O)O
InChI	InChI=1S/C25H36O6/c1-18(9-6-10-19(2)13-8-14-21(4)24(28)29)11-7-12-20(3)15-16-31-25(30)22(5)17-23(26)27/h10-11,14-15,17H,6-9,12-13,16H2,1-5H3,(H,26,27)(H,28,29)/b18-11+,19-10+,20-15+,21-14+,22-17+
InChIKey	RGDGFPUBWJTQHJ-HGJUBKMSSA-N

Species of Metabolite	Component	Source	Comments
Boletinus cavipes (ncbitaxon:85973)	-	PubMed (15217273)

ChEBI Ontology

Outgoing Relation(s)
	Boletinin J (CHEBI:202666) is a diterpenoid (CHEBI:23849)

IUPAC Name
(2E,6E,10E,14E)-16-[(E)-3-carboxy-2-methylprop-2-enoyl]oxy-2,6,10,14-tetramethylhexadeca-2,6,10,14-tetraenoic acid

Manual Xrefs	Databases
9537424	ChemSpider