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

MNXM91405 is deprecated and here replaced by MNXM737269
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM737269

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	3

formula

C₅₇H₈₅O₄

charge

-1

mass

833.64533

reference

chebi:62793

InChIKey

HGWUGDIATLOPBN-BHZQGFRMSA-M

InChI

InChI=1S/C57H86O4/c1-43(2)21-12-22-44(3)23-13-24-45(4)25-14-26-46(5)27-15-28-47(6)29-16-30-48(7)31-17-32-49(8)33-18-34-50(9)35-19-36-51(10)37-20-38-52(11)39-40-53-41-54(57(60)61)42-55(58)56(53)59/h21,23,25,27,29,31,33,35,37,39,41-42,58-59H,12-20,22,24,26,28,30,32,34,36,38,40H2,1-11H3,(H,60,61)/p-1/b44-23+,45-25+,46-27+,47-29+,48-31+,49-33+,50-35+,51-37+,52-39+

SMILES

CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/Cc1cc(C(=O)[O-])cc(O)c1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:62793 chebi:62793	3,4-dihydroxy-5-all-trans-decaprenylbenzoate 3,4-dihydroxy-5-decaprenylbenzoate 3-(3,7,11,15,19,23,27,31,35,39-decamethyltetracosa-2,6,10,14,18,22,26,30,34,38-decaenyl)-4,5-dihydroxybenzoate 3-[(2E,6E,10E,14E,18E,22E,26E,30E,34EE)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-yl]-4,5-dihydroxybenzoate 3-decaprenyl-4,5-dihydroxybenzoate all-trans-3,4-dihydroxy-5-decaprenylbenzoate all-trans-3-decaprenyl-4,5-dihydroxybenzoate
metacyc.compound:CPD-9895 metacycM:CPD-9895 seed.compound:cpd25894 seedM:cpd25894	3,4-dihydroxy-5-all-trans-decaprenylbenzoate 3-(3,7,11,15,19,23-decamethyltetracosa-2,6,10,14,18,22-hexaenyl) -4,5-dihydroxy-benzoic acid 3-decaprenyl-4,5-dihydroxybenzoate
bigg.metabolite:3dpdhb biggM:3dpdhb	3-Decaprenyl-4,5-dihdydroxybenzoate
hmdb:HMDB0060249	3-Decaprenyl-4,5-dihydroxybenzoate 3,4-Dihydroxy-5-decaprenylbenzoate 3,4-Dihydroxy-5-decaprenylbenzoic acid 3-(3,7,11,15,19,23,27,31,35,39-Decamethyltetracosa-2,6,10,14,18,22,26,30,34,38-decaenyl)-4,5-dihydroxybenzoate 3-(3,7,11,15,19,23,27,31,35,39-Decamethyltetracosa-2,6,10,14,18,22,26,30,34,38-decaenyl)-4,5-dihydroxybenzoic acid 3-Decaprenyl-4,5-dihydroxybenzoic acid 3-[(2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-yl]-4,5-dihydroxybenzoic acid all-trans-3,4-Dihydroxy-5-decaprenylbenzoate all-trans-3,4-Dihydroxy-5-decaprenylbenzoic acid all-trans-3-Decaprenyl-4,5-dihydroxybenzoate all-trans-3-Decaprenyl-4,5-dihydroxybenzoic acid
reactome:R-ALL-2162209 reactomeM:R-ALL-2162209 CHEBI:50775 chebi:50775	3-decaprenyl-4,5-dihydroxybenzoic acid 3,4-dihydroxy-5-decaprenylbenzoic acid 3-(3,7,11,15,19,23,27,31,35,39-decamethyltetracosa-2,6,10,14,18,22,26,30,34,38-decaenyl)-4,5-dihydroxybenzoic acid 3-[(2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-yl]-4,5-dihydroxybenzoic acid all-trans-3,4-dihydroxy-5-decaprenylbenzoic acid all-trans-3-decaprenyl-4,5-dihydroxybenzoic acid
lipidmaps:LMPR02010034 lipidmapsM:LMPR02010034	3-decaprenyl-4,5-dihydroxybenzoic acid 3-[(2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-yl]-4,5-dihydroxybenzoic acid
hmdb:HMDB60249 biggM:M_3dpdhb seedM:M_cpd25894	secondary/obsolete/fantasy identifier