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a (2S)-flavan-4-one

PropertiesImage
MNX_IDMNXM166745 Image of MNXM166745
referencemetacycM:2S-Flavanones
formulaC15H3O2*9
global charge0
mol weight 
InChIKey 
InChI 
SMILES[*]C1=C([*])C([*])=C([C@@H]2CC(=O)C3=C([*])C([*])=C([*])C([*])=C3O2)C([*])=C1[*]
MNX internals
InChI (mnx)InChI=1/C24H30O2/c1-11-12(2)16(6)22(17(7)13(11)3)21-10-20(25)23-18(8)14(4)15(5)19(9)24(23)26-21/h21H,10H2,1-9H3/t21-/m0/s1/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1 Image of MNXM166745
SMILES (mnx)[13CH3:1][C:11]1=[C:12]([13CH3:2])[C:16]([13CH3:6])=[C:22]([C@@H:21]2[CH2:10][C:20](=[O:25])[C:23]3=[C:18]([13CH3:8])[C:14]([13CH3:4])=[C:15]([13CH3:5])[C:19]([13CH3:9])=[C:24]3[O:26]2)[C:17]([13CH3:7])=[C:13]1[13CH3:3]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:2S-Flavanones
metacycM:2S-Flavanones
a (2S)-flavan-4-one