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5'-hydroxy-rot-2'-enonate

PropertiesImageOccurences in reactions
MNX_IDMNXM10272Image of MNXM10272
#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
formulaC23H23O7
charge-1
mass411.14493
referencemetacycM:CPD-9536
InChIKeySTQIAJVGXVCTSD-UKQHVQKXSA-M
InChIInChI=1S/C23H24O7/c1-12(10-24)4-5-13-16(25)7-6-14-22(26)21-15-8-18(27-2)19(28-3)9-17(15)29-11-20(21)30-23(13)14/h4,6-9,20-21,24-25H,5,10-11H2,1-3H3/p-1/b12-4-/t20-,21+/m1/s1
SMILESCOc1cc2c(cc1OC)[C@@H]1C(=O)c3ccc([O-])c(C/C=C(/C)CO)c3O[C@@H]1CO2
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
metacyc.compound:CPD-9536
metacycM:CPD-9536
seed.compound:cpd25725
seedM:cpd25725
5'-hydroxy-rot-2'-enonate
5'-hydroxy-rot-2'-enonic acid
seedM:M_cpd25725 secondary/obsolete/fantasy identifier