3'-hydroxyechinenone (CHEBI:80214)

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CHEBI:80214 - 3'-hydroxyechinenone

ChEBI ID	CHEBI:80214
ChEBI Name	3'-hydroxyechinenone
Stars
Definition	A member of the class of carotenone that is echinenone carrying an additional hydroxy substituent at position 3'. Found in cyanobacteria.
Last Modified	25 August 2015
Downloads	Molfile

Formula	C40H54O2
Net Charge	0
Average Mass	566.870
Monoisotopic Mass	566.41238
SMILES	CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C(=O)CCC2(C)C)C(C)(C)C[C@H](O)C1
InChI	InChI=1S/C40H54O2/c1-29(17-13-19-31(3)21-23-36-33(5)27-35(41)28-40(36,9)10)15-11-12-16-30(2)18-14-20-32(4)22-24-37-34(6)38(42)25-26-39(37,7)8/h11-24,35,41H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-/m1/s1
InChIKey	ZRCXVNZZDQGBQT-BANQPSJHSA-N

Wikipedia

Species of Metabolite	Component	Source	Comments
Synechocystis sp. (ncbitaxon:1148)	-	PubMed (24846130)	Strain: PCC 6803

Roles Classification

Biological Roles:

bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria.

biological pigment An endogenous molecular entity that results in a colour of an organism as the consequence of the selective absorption of light.

cofactor An organic molecule or ion (usually a metal ion) that is required by an enzyme for its activity. It may be attached either loosely (coenzyme) or tightly (prosthetic group).

ChEBI Ontology

Outgoing Relation(s)
	3'-hydroxyechinenone (CHEBI:80214) has functional parent echinenone (CHEBI:4746)
	3'-hydroxyechinenone (CHEBI:80214) has role bacterial metabolite (CHEBI:76969)
	3'-hydroxyechinenone (CHEBI:80214) has role biological pigment (CHEBI:26130)
	3'-hydroxyechinenone (CHEBI:80214) has role cofactor (CHEBI:23357)
	3'-hydroxyechinenone (CHEBI:80214) is a carotenone (CHEBI:35310)
	3'-hydroxyechinenone (CHEBI:80214) is a enone (CHEBI:51689)
	3'-hydroxyechinenone (CHEBI:80214) is a secondary alcohol (CHEBI:35681)

IUPAC Name
(3'R)-3'-hydroxy-β,β-caroten-4-one

Synonyms	Source
3-{(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4R)-4-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl}-2,4,4-trimethylcyclohex-2-en-1-one	IUPAC
3'-hydroxy-β,β-caroten-4-one	ChEBI
(3'R)-3'-hydroxy-echinenone	ChEBI
3'-OH-Echinenone	LIPID MAPS
hECN	ChEBI
HEQ	ChEBI

UniProt Name	Source
3'-hydroxyechinenone	UniProt

Manual Xrefs	Databases
3%27-Hydroxyechinenone	Wikipedia
C15965	KEGG COMPOUND
LMPR01070098	LIPID MAPS

Registry Numbers	Sources
Reaxys:6024554	Reaxys

Citations