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3,7,11,15-tetramethylhexadecanoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM731141

	#reac
in my sandbox	0
in MNXref (generic)	8
in models (compartimentalized)	10

formula

C₂₀H₃₉O₂

charge

-1

mass

311.29555

reference

chebi:37257

InChIKey

RLCKHJSFHOZMDR-UHFFFAOYSA-M

InChI

InChI=1S/C20H40O2/c1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-19(5)15-20(21)22/h16-19H,6-15H2,1-5H3,(H,21,22)/p-1

SMILES

CC(C)CCCC(C)CCCC(C)CCCC(C)CC(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:37257 chebi:37257	3,7,11,15-tetramethylhexadecanoate 3,7,11,15-tetramethylpalmitate phytanate phytanate anion
bigg.metabolite:CE2414 biggM:CE2414	(3S,7R,11R)-phytanate
seed.compound:cpd01130 seedM:cpd01130	Phytanate 3,7,11,15-Tetramethylhexadecanoic acid 3,7,11,15-tetramethylhexadecanoate 3,7,11,15-tetramethylpalmitate Phytanic acid phytanate phytanic acid
kegg.compound:C01607 keggC:C01607	Phytanate 3,7,11,15-Tetramethylhexadecanoic acid Phytanic acid
sabiork.compound:5693 sabiorkM:5693	Phytanate Phytanic acid
bigg.metabolite:phyt biggM:phyt	Phytanic acid
hmdb:HMDB0000801	Phytanic acid 3,7,11,15-Tetramethyl hexadecanoate 3,7,11,15-Tetramethyl hexadecanoic acid 3,7,11,15-Tetramethyl-hexadecanoate 3,7,11,15-Tetramethyl-hexadecanoic acid 3,7,11,15-Tetramethyl-hexadecansaeure 3,7,11,15-Tetramethylhexadecanoate 3,7,11,15-Tetramethylhexadecanoic acid 3,7,11,15-Tetramethylhexadecoanoate 3,7,11,15-Tetramethylhexadecoanoic acid 3,7,11,15-tetramethylhexadecanoic acid Acid, phytanic Phytanate Phytanoate Phytanoic acid phytanic acid
metacyc.compound:PHYTANATE metacycM:PHYTANATE	phytanate 3,7,11,15-tetramethylhexadecanoate 3,7,11,15-tetramethylpalmitate phytanic acid
reactome:R-ALL-389596 reactomeM:R-ALL-389596 CHEBI:16285 chebi:16285	phytanic acid 3,7,11,15-Tetramethyl-hexadecansaeure 3,7,11,15-tetramethyl hexadecanoic acid 3,7,11,15-tetramethyl-hexadecanoic acid 3,7,11,15-tetramethylhexadecanoic acid Phytanic acid
hmdb:HMDB00801 chebi:14834 chebi:26109 chebi:26111 chebi:8189 biggM:M_CE2414 biggM:M_phyt keggC:M_C01607 seedM:M_cpd01130	secondary/obsolete/fantasy identifier