Varioxiranol L (CHEBI:201012)

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CHEBI:201012 - Varioxiranol L

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ChEBI ID	CHEBI:201012
ChEBI Name	Varioxiranol L
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C22H28O7
Net Charge	0
Average Mass	404.459
Monoisotopic Mass	404.18350
SMILES	CC[C@H]1O[C@@H]2O[C@H](C=CC=CC=Cc3cc(OC)cc(=O)o3)[C@H](O)[C@]2(C)[C@@]1(C)O
InChI	InChI=1S/C22H28O7/c1-5-17-22(3,25)21(2)19(24)16(28-20(21)29-17)11-9-7-6-8-10-14-12-15(26-4)13-18(23)27-14/h6-13,16-17,19-20,24-25H,5H2,1-4H3/t16-,17-,19+,20+,21+,22+/m1/s1
InChIKey	HITOGNCAEBBQJD-OLAQMGEPSA-N

Species of Metabolite	Component	Source	Comments
Aspergillus stellatus (ncbitaxon:1549217)	-	PubMed (26700546)

ChEBI Ontology

Outgoing Relation(s)
	Varioxiranol L (CHEBI:201012) is a furofuran (CHEBI:47790)

IUPAC Name
6-[6-[(2R,3R,3aR,4R,5R,6aS)-2-ethyl-3,4-dihydroxy-3,3a-dimethyl-2,4,5,6a-tetrahydrouro[2,3-b]uran-5-yl]hexa-1,3,5-trienyl]-4-methoxypyran-2-one