Microporenic acid B (CHEBI:209011)

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CHEBI:209011 - Microporenic acid B

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ChEBI ID	CHEBI:209011
ChEBI Name	Microporenic acid B
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C27H42O7
Net Charge	0
Average Mass	478.626
Monoisotopic Mass	478.29305
SMILES	COC(=O)C[C@H](C(=O)O)[C@@H](OC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)C(=O)O
InChI	InChI=1S/C27H42O7/c1-19(2)10-7-11-20(3)12-8-13-21(4)14-9-15-22(5)16-17-34-25(27(31)32)23(26(29)30)18-24(28)33-6/h10,12,14,16,23,25H,7-9,11,13,15,17-18H2,1-6H3,(H,29,30)(H,31,32)/b20-12+,21-14+,22-16+/t23-,25+/m0/s1
InChIKey	ZBDVBGZCDFAFSD-WUHCIOOHSA-N

Species of Metabolite	Component	Source	Comments
Microporusspecies (in: basidiomycete fungi) (ncbitaxon:2007320)	-	PubMed (29489350)

ChEBI Ontology

Outgoing Relation(s)
	Microporenic acid B (CHEBI:209011) is a diterpenoid (CHEBI:23849)

IUPAC Name
(2S,3R)-2-(2-methoxy-2-oxoethyl)-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenoxy]butanedioic acid

Manual Xrefs	Databases
78439045	ChemSpider