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(3S,6R)-6-hydroxy-3-isopropenylheptanoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM2891

	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	0

formula

C₁₀H₁₇O₃

charge

-1

mass

185.24018

reference

InChIKey

NQYDFAGFKCSWGI-BDAKNGLRSA-M

InChI

InChI=1S/C10H18O3/c1-7(2)9(6-10(12)13)5-4-8(3)11/h8-9,11H,1,4-6H2,2-3H3,(H,12,13)/p-1/t8-,9+/m1/s1

SMILES

C[C@@H](O)CC[C@@H](CC([O-])=O)C(C)=C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:64226 chebi:64226	(3S,6R)-6-hydroxy-3-isopropenylheptanoate (3S,6R)-6-hydroxy-3-(prop-1-en-2-yl)heptanoate (3S,6R)-6-hydroxy-3-isopropenylheptanoate(1-)
seed.compound:cpd08271 seedM:cpd08271 CHEBI:214 chebi:214 kegg.compound:C11417 keggC:C11417	(3S)-6-Hydroxy-3-isopropenyl-heptanoate 6-Hydroxy-3-isopropenylheptanoate
metacyc.compound:CPD-10065 metacycM:CPD-10065 seed.compound:cpd22540 seedM:cpd22540	(3S,6R)-6-hydroxy-3-isopropenyl-heptanoate
CHEBI:64249 chebi:64249	(3S,6R)-6-hydroxy-3-isopropenylheptanoic acid (3S,6R)-6-hydroxy-3-(prop-1-en-2-yl)heptanoic acid
keggC:M_C11417 seedM:M_cpd08271 seedM:M_cpd22540	secondary/obsolete/fantasy identifier