Synechoxanthin (CHEBI:209001)

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CHEBI:209001 - Synechoxanthin

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ChEBI ID	CHEBI:209001
ChEBI Name	Synechoxanthin
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C40H44O4
Net Charge	0
Average Mass	588.788
Monoisotopic Mass	588.32396
SMILES	CC(/C=C/C=C(C)/C=C/c1ccc(C(=O)O)c(C)c1C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\c1ccc(C(=O)O)c(C)c1C
InChI	InChI=1S/C40H44O4/c1-27(15-11-17-29(3)19-21-35-23-25-37(39(41)42)33(7)31(35)5)13-9-10-14-28(2)16-12-18-30(4)20-22-36-24-26-38(40(43)44)34(8)32(36)6/h9-26H,1-8H3,(H,41,42)(H,43,44)/b10-9+,15-11+,16-12+,21-19+,22-20+,27-13+,28-14+,29-17+,30-18+
InChIKey	BFYXFUUHZKWAJW-TUOVYMBRSA-N

Species of Metabolite	Component	Source	Comments
Synechococcusspecies PCC 7002 (ncbitaxon:32049)	-	PubMed (18715035)

ChEBI Ontology

Outgoing Relation(s)
	Synechoxanthin (CHEBI:209001) is a diterpenoid (CHEBI:23849)

IUPAC Name
4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-(4-carboxy-2,3-dimethylphenyl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-2,3-dimethylbenzoic acid

Manual Xrefs	Databases
28285568	ChemSpider