CHEBI:57916 - 3-hexaprenyl-4-hydroxy-5-methoxybenzoate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-hexaprenyl-4-hydroxy-5-methoxybenzoate
ChEBI ID CHEBI:57916
Definition A 3-methoxy-4-hydroxy-5-all-trans-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
more structures >>
Formula C38H55O4
Net Charge -1
Average Mass 575.84140
Monoisotopic Mass 575.41058
InChI InChI=1S/C38H56O4/c1-28(2)14-9-15-29(3)16-10-17-30(4)18-11-19-31(5)20-12-21-32(6)22-13-23-33(7)24-25-34-26-35(38(40)41)27-36(42-8)37(34)39/h14,16,18,20,22,24,26-27,39H,9-13,15,17,19,21,23,25H2,1-8H3,(H,40,41)/p-1/b29-16+,30-18+,31-20+,32-22+,33-24+
InChIKey YSZSVGFMAJXGMQ-FRICUITQSA-M
SMILES COc1cc(cc(C\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CCC=C(C)C)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-hydroxy-5-methoxybenzoate (CHEBI:57916) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
3-hexaprenyl-4-hydroxy-5-methoxybenzoate (CHEBI:57916) is a 3-methoxy-4-hydroxy-5-all-trans-polyprenylbenzoate (CHEBI:84443)
3-hexaprenyl-4-hydroxy-5-methoxybenzoate (CHEBI:57916) is conjugate base of 3-hexaprenyl-4-hydroxy-5-methoxybenzoic acid (CHEBI:16835)
Incoming 3-hexaprenyl-4-hydroxy-5-methoxybenzoic acid (CHEBI:16835) is conjugate acid of 3-hexaprenyl-4-hydroxy-5-methoxybenzoate (CHEBI:57916)
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-hydroxy-5-methoxybenzoate
Synonyms Sources
3-hexaprenyl-4-hydroxy-5-methoxybenzoate anion ChEBI
3-hexaprenyl-4-hydroxy-5-methoxybenzoate(1−) ChEBI
4-hydroxy-3-methoxy-5-(all-trans-hexaprenyl)benzoate UniProt
Last Modified
07 November 2024