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2-methoxy-6-(all-trans-decaprenyl)phenol

PropertiesImage
MNX_IDMNXM4967 Image of MNXM4967
referencechebi:50774
formulaC57H88O2
global charge0
mol weight805.329
InChIKeyFYLLWSGFAAQKHU-GBBROCKZSA-N
InChIInChI=1S/C57H88O2/c1-45(2)23-13-24-46(3)25-14-26-47(4)27-15-28-48(5)29-16-30-49(6)31-17-32-50(7)33-18-34-51(8)35-19-36-52(9)37-20-38-53(10)39-21-40-54(11)43-44-55-41-22-42-56(59-12)57(55)58/h22-23,25,27,29,31,33,35,37,39,41-43,58H,13-21,24,26,28,30,32,34,36,38,40,44H2,1-12H3/b46-25+,47-27+,48-29+,49-31+,50-33+,51-35+,52-37+,53-39+,54-43+
SMILESCOC1=CC=CC(C/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)CCC=C(C)C)=C1O
MNX internals
InChI (mnx)InChI=1/C57H88O2/c1-45(2)23-13-24-46(3)25-14-26-47(4)27-15-28-48(5)29-16-30-49(6)31-17-32-50(7)33-18-34-51(8)35-19-36-52(9)37-20-38-53(10)39-21-40-54(11)43-44-55-41-22-42-56(59-12)57(55)58/h22-23,25,27,29,31,33,35,37,39,41-43,58H,13-21,24,26,28,30,32,34,36,38,40,44H2,1-12H3/b46-25+,47-27+,48-29+,49-31+,50-33+,51-35+,52-37+,53-39+,54-43+ Image of MNXM4967
SMILES (mnx)[CH3:1][C:45]([CH3:2])=[CH:23][CH2:13][CH2:24]/[C:46]([CH3:3])=[CH:25]/[CH2:14][CH2:26]/[C:47]([CH3:4])=[CH:27]/[CH2:15][CH2:28]/[C:48]([CH3:5])=[CH:29]/[CH2:16][CH2:30]/[C:49]([CH3:6])=[CH:31]/[CH2:17][CH2:32]/[C:50]([CH3:7])=[CH:33]/[CH2:18][CH2:34]/[C:51]([CH3:8])=[CH:35]/[CH2:19][CH2:36]/[C:52]([CH3:9])=[CH:37]/[CH2:20][CH2:38]/[C:53]([CH3:10])=[CH:39]/[CH2:21][CH2:40]/[C:54]([CH3:11])=[CH:43]/[CH2:44][C:55]1=[C:57]([OH:58])[C:56]([O:59][CH3:12])=[CH:42][CH:22]=[CH:41]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 5
Similar chemical compounds in external resources
IdentifierDescription

reactome:R-ALL-2162208
reactomeM:R-ALL-2162208
CHEBI:50774
chebi:50774
FYLLWSGFAAQKHU-GBBROCKZSA-N 		2-methoxy-6-(all-trans-decaprenyl)phenol
2-[(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]-6-methoxyphenol
2-decaprenyl-6-methoxyphenol

bigg.metabolite:2dp6mep
biggM:2dp6mep
FYLLWSGFAAQKHU-GBBROCKZSA-N 		2-Decaprenyl-6-methoxyphenol
hmdb:HMDB0060250
FYLLWSGFAAQKHU-GBBROCKZSA-N 		2-Decaprenyl-6-methoxyphenol
2-Methoxy-6-(all-trans-decaprenyl)phenol
2-[(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]-6-methoxyphenol
2-decaprenyl-6-methoxyphenol

vmhM:2dp6mep
vmhmetabolite:2dp6mep
FYLLWSGFAAQKHU-GBBROCKZSA-N 		2-Decaprenyl-6-methoxyphenol
2-[(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]-6-methoxyphenol

seed.compound:cpd25881
seedM:cpd25881
FYLLWSGFAAQKHU-GBBROCKZSA-N 		2-methoxy-6-(all-trans-decaprenyl)phenol
6-(all-trans-decaprenyl)-2-methoxy-phenol

metacyc.compound:CPD-9865
metacycM:CPD-9865
FYLLWSGFAAQKHU-GBBROCKZSA-N 		6-(all-trans-decaprenyl)-2-methoxy-phenol

hmdb:HMDB60250
biggM:M_2dp6mep
seedM:M_cpd25881
vmhM:M_2dp6mep 		secondary/obsolete/fantasy identifier