CHEBI:58373 - 3-hexaprenyl-4,5-dihydroxybenzoate

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ChEBI Name 3-hexaprenyl-4,5-dihydroxybenzoate
ChEBI ID CHEBI:58373
Definition A 3,4-dihydroxy-5-polyprenylbenzoate in which the polyprenyl chain contains 6 prenyl units; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C37H53O4
Net Charge -1
Average Mass 561.81430
Monoisotopic Mass 561.39493
InChI InChI=1S/C37H54O4/c1-27(2)13-8-14-28(3)15-9-16-29(4)17-10-18-30(5)19-11-20-31(6)21-12-22-32(7)23-24-33-25-34(37(40)41)26-35(38)36(33)39/h13,15,17,19,21,23,25-26,38-39H,8-12,14,16,18,20,22,24H2,1-7H3,(H,40,41)/p-1/b28-15+,29-17+,30-19+,31-21+,32-23+
InChIKey VEPICJBQCOUQPI-IRVXXIIISA-M
SMILES CC(C)=CCC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\Cc1cc(cc(O)c1O)C([O-])=O
Metabolite of Species Details
Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3-hexaprenyl-4,5-dihydroxybenzoate (CHEBI:58373) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
3-hexaprenyl-4,5-dihydroxybenzoate (CHEBI:58373) is a 3,4-dihydroxy-5-polyprenylbenzoate (CHEBI:64694)
3-hexaprenyl-4,5-dihydroxybenzoate (CHEBI:58373) is conjugate base of 3-hexaprenyl-4,5-dihydroxybenzoic acid (CHEBI:18081)
Incoming 3-hexaprenyl-4,5-dihydroxybenzoic acid (CHEBI:18081) is conjugate acid of 3-hexaprenyl-4,5-dihydroxybenzoate (CHEBI:58373)
IUPAC Name
3-[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl]-4,5-dihydroxybenzoate
Synonyms Sources
3,4-dihydroxy-5-(all-trans-hexaprenyl)benzoate UniProt
3-hexaprenyl-4,5-dihydroxybenzoate anion ChEBI
3-hexaprenyl-4,5-dihydroxybenzoate(1−) ChEBI
Last Modified
25 September 2024