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isoepoxydon

Properties

Image

with InChI numbering

Occurences in reactions

MNX_ID

MNXM148289

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₇H₈O₄

charge

mass

156.137

reference

InChIKey

VTLJDPHPVHSVGR-JHYUDYDFSA-N

InChI

InChI=1S/C7H8O4/c8-2-3-1-4(9)6-7(11-6)5(3)10/h1,4,6-9H,2H2/t4-,6+,7-/m0/s1

SMILES

[CH:1]1=[C:3]([CH2:2][OH:8])[C:5](=[O:10])[C@H:7]2[C@@H:6]([C@H:4]1[OH:9])[O:11]2

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:145109 chebi:145109	isoepoxydon (+)-isoepoxydon (1R,5S,6R)-5-hydroxy-3-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-en-2-one (4S,5R,6R)-5,6-epoxy-4-hydroxy-2-hydroxymethylcyclohex-2-en-1-one
seed.compound:cpd35681 seedM:cpd35681	(4S,5R,6R)-5,6-epoxy-4-hydroxy-2-hydroxymethylcyclohex-2-en-1-one isoepoxydon
metacyc.compound:CPD-16723 metacycM:CPD-16723	isoepoxydon (4R,5S,6S)-5,6-epoxy-4-hydroxy-2-hydroxymethylcyclohex-2-en-1-one
seedM:M_cpd35681	secondary/obsolete/fantasy identifier