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1,5-Dibutyl methyl hydroxycitrate

Properties

Image

Occurences in reactions

MNX_ID

MNXM115775

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

formula

C₁₅H₂₆O₈

charge

mass

334.16277

reference

InChIKey

JRMBFEKUMNWOIE-UHFFFAOYSA-N

InChI

InChI=1S/C15H26O8/c1-4-6-8-22-11(16)10-15(20,14(19)21-3)12(17)13(18)23-9-7-5-2/h12,17,20H,4-10H2,1-3H3

SMILES

CCCCOC(=O)CC(O)(C(=O)OC)C(O)C(=O)OCCCC

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:168588 chebi:168588	1,5-Dibutyl methyl hydroxycitrate 1-O,3-O-dibutyl 2-O-methyl 1,2-dihydroxypropane-1,2,3-tricarboxylate
hmdb:HMDB0040461	1,5-Dibutyl methyl hydroxycitrate 1,3-Dibutyl 2-methyl 1,2-dihydroxypropane-1,2,3-tricarboxylic acid 1,3-dibutyl 2-methyl 1,2-dihydroxypropane-1,2,3-tricarboxylate 1,5-Dibutyl methyl hydroxycitric acid
hmdb:HMDB40461	secondary/obsolete/fantasy identifier