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2-epi-5-epi-valiolone

PropertiesImage
MNX_IDMNXM9820 Image of MNXM9820
referencechebi:84187
formulaC7H12O6
global charge0
mol weight192.167
InChIKeyJCZFNXYQGNLHDQ-MVIOUDGNSA-N
InChIInChI=1S/C7H12O6/c8-2-7(13)1-3(9)4(10)5(11)6(7)12/h4-6,8,10-13H,1-2H2/t4-,5-,6+,7-/m1/s1
SMILESO=C1C[C@@](O)(CO)[C@@H](O)[C@H](O)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C7H12O6/c8-2-7(13)1-3(9)4(10)5(11)6(7)12/h4-6,8,10-13H,1-2H2/t4-,5-,6+,7-/m1/s1 Image of MNXM9820
SMILES (mnx)[CH2:1]1[C:3](=[O:9])[C@@H:4]([OH:10])[C@@H:5]([OH:11])[C@H:6]([OH:12])[C@@:7]1([CH2:2][OH:8])[OH:13]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:84187
chebi:84187
JCZFNXYQGNLHDQ-MVIOUDGNSA-N 		2-epi-5-epi-valiolone
(2S,3S,4S,5R)-2,3,4,5-tetrahydroxy-5-(hydroxymethyl)cyclohexanone

kegg.compound:C17691
keggC:C17691
JCZFNXYQGNLHDQ-MVIOUDGNSA-N 		2-epi-5-epi-Valiolone
(2S,3S,4S,5R)-2,3,4,5-Tetrahydroxy-5-(hydroxymethyl)cyclohexan-1-one

metacyc.compound:CPD-9663
metacycM:CPD-9663
seed.compound:cpd25777
seedM:cpd25777
JCZFNXYQGNLHDQ-MVIOUDGNSA-N 		2-epi-5-epi-valiolone
(2S,3S,4S,5R)-2,3,4,5-tetrahydroxy-5-(hydroxymethyl)cyclohexan-1-one

keggC:M_C17691
seedM:M_cpd25777 		secondary/obsolete/fantasy identifier