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2E-Phytenoic acid

PropertiesImage
MNX_IDMNXM97657 Image of MNXM97657
referencechebi:180283
formulaC20H38O2
global charge0
mol weight310.522
InChIKeyWDWBNNBRPVEEOD-PFXVRADUSA-N
InChIInChI=1S/C20H38O2/c1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-19(5)15-20(21)22/h15-18H,6-14H2,1-5H3,(H,21,22)/b19-15+/t17-,18-/m1/s1
SMILESC/C(=C\C(=O)O)CCC[C@H](C)CCC[C@H](C)CCCC(C)C
MNX internals
InChI (mnx)InChI=1/C20H38O2/c1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-19(5)15-20(21)22/h15-18H,6-14H2,1-5H3,(H,21,22)/b19-15+/t17-,18-/m1/s1 Image of MNXM97657
SMILES (mnx)[CH3:1][CH:16]([CH3:2])[CH2:9][CH2:6][CH2:10][C@@H:17]([CH3:3])[CH2:11][CH2:7][CH2:12][C@@H:18]([CH3:4])[CH2:13][CH2:8][CH2:14]/[C:19]([CH3:5])=[CH:15]/[C:20](=[O:21])[OH:22]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:180283
chebi:180283
WDWBNNBRPVEEOD-PFXVRADUSA-N 		2E-Phytenoic acid
(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enoic acid

seed.compound:cpd35338
seedM:cpd35338
WDWBNNBRPVEEOD-PFXVRADUSA-M 		(E)-3,7,11,15-tetramethylhexadec-2-enoic acid
2E-phytenate
2E-phytenic acid
3,7,11,15-tetramethyl-2E-hexadecenoic acid
phytenate

lipidmaps:LMPR0104010023
lipidmapsM:LMPR0104010023
WDWBNNBRPVEEOD-PFXVRADUSA-N 		2E-Phytenoic acid
3,7,11,15-tetramethyl-2-Hexadecenoic acid
3,7R,11R,15-tetramethyl-2E-hexadecenoic acid
Delta2-Phytenic acid
Phytenic acid
Phytenoic acid

metacyc.compound:CPD-14927
metacycM:CPD-14927
WDWBNNBRPVEEOD-PFXVRADUSA-M 		phytenate
(E)-3,7,11,15-tetramethylhexadec-2-enoic acid
2E-phytenate
2E-phytenic acid
3,7,11,15-tetramethyl-2E-hexadecenoic acid

seedM:M_cpd35338 		secondary/obsolete/fantasy identifier