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ascopyrone M

MNXM114123 is deprecated and here replaced by MNXM1364726
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1364726 Image of MNXM1364726
referencechebi:50070
formulaC6H8O4
global charge0
mol weight144.126
InChIKeyXUKJGZOHRVCEJL-BYPYZUCNSA-N
InChIInChI=1S/C6H8O4/c7-2-4-1-5(8)6(9)3-10-4/h1,4,7-8H,2-3H2/t4-/m0/s1
SMILESO=C1CO[C@H](CO)C=C1O
MNX internals
InChI (mnx)InChI=1/C6H8O4/c7-2-4-1-5(8)6(9)3-10-4/h1,4,7-8H,2-3H2/t4-/m0/s1 Image of MNXM1364726
SMILES (mnx)[CH:1]1=[C:5]([OH:8])[C:6](=[O:9])[CH2:3][O:10][C@@H:4]1[CH2:2][OH:7]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:50070
chebi:50070
XUKJGZOHRVCEJL-BYPYZUCNSA-N 		ascopyrone M
(6S)-4-hydroxy-6-(hydroxymethyl)-2H-pyran-3(6H)-one
1,5-anhydro-4-deoxy-D-glycero-hex-3-en-2-ulose
APM

kegg.compound:C19822
keggC:C19822
XUKJGZOHRVCEJL-BYPYZUCNSA-N 		1,5-Anhydro-4-deoxy-D-glycero-hex-3-en-2-ulose
Ascopyrone M

envipath:...8df55baef2f3
envipathM:...8df55baef2f3
XUKJGZOHRVCEJL-BYPYZUCNSA-N 		Ascopyrone M

CHEBI:58806
chebi:58806
XUKJGZOHRVCEJL-BYPYZUCNSA-M 		ascopyrone M(1-)
(6S)-6-(hydroxymethyl)-3-oxo-3,6-dihydro-2H-pyran-4-olate
ascopyrone M anion

metacyc.compound:CPD-9432
metacycM:CPD-9432
XUKJGZOHRVCEJL-BYPYZUCNSA-N 		ascopyrone M
(6S)-4-hydroxy-6-(hydroxymethyl)-2H-pyran-3(6H)-one
1,5-anhydro-4-deoxy-D-glycero-hex-3-en-2-ulose

keggC:M_C19822 		secondary/obsolete/fantasy identifier