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3,4-dihydroxy-5-all-trans-hexaprenylbenzoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM2783

	#reac
in my sandbox	0
in MNXref (generic)	14
in models (compartimentalized)	4

formula

C₃₇H₅₃O₄

charge

-1

mass

561.81432

reference

chebi:58373

InChIKey

VEPICJBQCOUQPI-IRVXXIIISA-M

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+

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58373 chebi:58373	3,4-dihydroxy-5-all-trans-hexaprenylbenzoate 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 3-hexaprenyl-4,5-dihydroxybenzoate 3-hexaprenyl-4,5-dihydroxybenzoate anion 3-hexaprenyl-4,5-dihydroxybenzoate(1-)
bigg.metabolite:3dh5hpb biggM:3dh5hpb	3 Hexaprenyl 4 5 dihydroxybenzoate
hmdb:HMDB0001063	3-Hexaprenyl-4,5-Dihydroxybenzoic acid 3,4-Dihydroxy-5-hexaprenylbenzoate 3,4-Dihydroxy-5-hexaprenylbenzoic acid 3-Hexaprenyl-4,5-dihydroxybenzoate 3-[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl]-4,5-dihydroxybenzoic acid Dhhpba dhhpba
kegg.compound:C05200 keggC:C05200	3-Hexaprenyl-4,5-dihydroxybenzoate
seed.compound:cpd03092 seedM:cpd03092	3-Hexaprenyl-4,5-dihydroxybenzoate 3,4-dihydroxy-5-all-trans-hexaprenylbenzoate 3-(3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaenyl) -4,5-dihydroxy-benzoic acid 3-hexaprenyl-4,5-dihydroxybenzoate 3dh5hpb
metacyc.compound:CPD-21768 metacycM:CPD-21768	3-all trans-hexaprenyl-4,5-dihydroxybenzoate 3,4-dihydroxy-5-all-trans-hexaprenylbenzoate 3-(3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaenyl) -4,5-dihydroxy-benzoic acid 3-hexaprenyl-4,5-dihydroxybenzoate 3-hexaprenyl-4-,5-dihydroxybenzoic acid
reactome:R-ALL-2162278 reactomeM:R-ALL-2162278 CHEBI:18081 chebi:18081	3-hexaprenyl-4,5-dihydroxybenzoic acid 3-Hexaprenyl-4,5-dihydroxybenzoate 3-[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl]-4,5-dihydroxybenzoic acid
lipidmaps:LMPR02010043 lipidmapsM:LMPR02010043	LMPR02010043 3-Hexaprenyl-4,5-dihydroxybenzoic acid
hmdb:HMDB01063 chebi:11798 chebi:1509 chebi:20027 biggM:M_3dh5hpb keggC:M_C05200 seedM:M_cpd03092	secondary/obsolete/fantasy identifier