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omega-hydroxy-3,7,11,15-tetramethyl-hexadecanoate

PropertiesImage
MNX_IDMNXM147246 Image of MNXM147246
referencechebi:83916
formulaC20H39O3
global charge-1
mol weight327.529
InChIKeyCBZPGRKSSXCZLI-UHFFFAOYSA-M
InChIInChI=1S/C20H40O3/c1-16(10-6-12-18(3)14-20(22)23)8-5-9-17(2)11-7-13-19(4)15-21/h16-19,21H,5-15H2,1-4H3,(H,22,23)/p-1
SMILESCC(CO)CCCC(C)CCCC(C)CCCC(C)CC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C20H40O3/c1-16(10-6-12-18(3)14-20(22)23)8-5-9-17(2)11-7-13-19(4)15-21/h16-19,21H,5-15H2,1-4H3,(H,22,23)/t16?,17?,18?,19? Image of MNXM147246
SMILES (mnx)[CH3:1][CH:16]([CH2:8][CH2:5][CH2:9][CH:17]([CH3:2])[CH2:11][CH2:7][CH2:13][CH:19]([CH3:4])[CH2:15][OH:21])[CH2:10][CH2:6][CH2:12][CH:18]([CH3:3])[CH2:14][C:20](=[O:22])[OH:23]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:83916
chebi:83916
CBZPGRKSSXCZLI-UHFFFAOYSA-M 		omega-hydroxy-3,7,11,15-tetramethyl-hexadecanoate
16-hydroxy-3,7,11,15-tetramethylhexadecanoate
omega-hydroxyphytanate

seed.compound:cpd35279
seedM:cpd35279
CBZPGRKSSXCZLI-UHFFFAOYSA-M 		16-hydroxy-3,7,11,15-tetramethylhexadecanoate
16-hydroxy-3,7,11,15-tetramethylpalmitate
16-hydroxy-phytanic acid
16-hydroxyphytanate

metacyc.compound:CPD-18172
metacycM:CPD-18172
CBZPGRKSSXCZLI-UHFFFAOYSA-M 		16-hydroxyphytanate
16-hydroxy-3,7,11,15-tetramethylhexadecanoate
16-hydroxy-3,7,11,15-tetramethylpalmitate
16-hydroxy-phytanic acid

SLM:000399834
slm:000399834
CBZPGRKSSXCZLI-UHFFFAOYSA-M 		omega-hydroxy-3,7,11,15-tetramethyl-hexadecanoate

CHEBI:84925
chebi:84925
CBZPGRKSSXCZLI-UHFFFAOYSA-N 		omega-hydroxyphytanic acid
16-hydroxy-3,7,11,15-tetramethylhexadecanoic acid

seedM:M_cpd35279 		secondary/obsolete/fantasy identifier