(3R)-2,4-dimethyl-5-phenyl-4-pentene-2,3-diol (CHEBI:225980)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:225980 - (3R)-2,4-dimethyl-5-phenyl-4-pentene-2,3-diol

Take structure to advanced search

ChEBI ID	CHEBI:225980
ChEBI Name	(3R)-2,4-dimethyl-5-phenyl-4-pentene-2,3-diol
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C13H18O2
Net Charge	0
Average Mass	206.285
Monoisotopic Mass	206.13068
SMILES	C/C(=C\c1ccccc1)[C@@H](O)C(C)(C)O
InChI	InChI=1S/C13H18O2/c1-10(12(14)13(2,3)15)9-11-7-5-4-6-8-11/h4-9,12,14-15H,1-3H3/b10-9+/t12-/m1/s1
InChIKey	FQJOZKJBYHVICA-BZYZDCJZSA-N

Species of Metabolite	Component	Source	Comments
Favolaschia (ncbitaxon:139071)	-	PubMed (32193929)

ChEBI Ontology

Outgoing Relation(s)
	(3R)-2,4-dimethyl-5-phenyl-4-pentene-2,3-diol (CHEBI:225980) is a phenylpropanoid (CHEBI:26004)

IUPAC Name
(E,3R)-2,4-dimethyl-5-phenylpent-4-ene-2,3-diol

Manual Xrefs	Databases
10396333	ChemSpider