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cicerin

PropertiesImageOccurences in reactions
MNX_IDMNXM46732Image of MNXM46732
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC17H13O7
charge-1
mass329.06668
referencemetacycM:CPD-4565
InChIKeyMNXNLFUKHPLPES-JTQLQIEISA-M
InChIInChI=1S/C17H14O7/c1-21-12-5-14-13(23-7-24-14)4-9(12)10-6-22-15-3-8(18)2-11(19)16(15)17(10)20/h2-5,10,18-19H,6-7H2,1H3/p-1/t10-/m0/s1
SMILESCOc1cc2c(cc1[C@@H]1COc3cc([O-])cc(O)c3C1=O)OCO2
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
metacyc.compound:CPD-4565
metacycM:CPD-4565
seed.compound:cpd24495
seedM:cpd24495
cicerin
hmdb:HMDB0038659 Cicerin
(3R3S)-Onogenin
2-Chloro-1-cyclopentanone
2-Chloro-cyclopentanone
2-Chlorocyclopentan-one
2-Chlorocyclopentanone
5,7-Dihydroxy-2'-methoxy-4',5'-methylenedioxyisoflavanone
5,7-dihydroxy-3-(6-methoxy-2H-1,3-benzodioxol-5-yl)-2,3-dihydro-1-benzopyran-4-one
5,7-dihydroxy-3-(6-methoxy-2H-1,3-benzodioxol-5-yl)-3,4-dihydro-2H-1-benzopyran-4-one
alpha-Chlorocyclopentanone
CHEBI:174460
chebi:174460
Cicerin
5,7-dihydroxy-3-(6-methoxy-1,3-benzodioxol-5-yl)-2,3-dihydrochromen-4-one
hmdb:HMDB38659
seedM:M_cpd24495
secondary/obsolete/fantasy identifier