Tanzawaic acid Q (CHEBI:211822)

EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:211822 - Tanzawaic acid Q

Take structure to advanced search

ChEBI ID	CHEBI:211822
ChEBI Name	Tanzawaic acid Q
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C18H26O3
Net Charge	0
Average Mass	290.403
Monoisotopic Mass	290.18819
SMILES	CC1=C[C@@H](O)[C@H]2C[C@@H](C)C[C@@H](C)[C@@H]2[C@H]1/C=C/C=C/C(=O)O
InChI	InChI=1S/C18H26O3/c1-11-8-13(3)18-14(6-4-5-7-17(20)21)12(2)10-16(19)15(18)9-11/h4-7,10-11,13-16,18-19H,8-9H2,1-3H3,(H,20,21)/b6-4+,7-5+/t11-,13+,14-,15+,16+,18+/m0/s1
InChIKey	IAHHBCJGIPEJRS-QMVQBUPGSA-N

Species of Metabolite	Component	Source	Comments
Penicillium (ncbitaxon:5073)	-	PubMed (26761016)

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	Tanzawaic acid Q (CHEBI:211822) is a medium-chain fatty acid (CHEBI:59554)

IUPAC Name
(2E,4E)-5-[(1R,4S,4aS,6S,8R,8aR)-4-hydroxy-2,6,8-trimethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]penta-2,4-dienoic acid

Manual Xrefs	Databases
58196492	ChemSpider