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neobavaisoflavone

Properties

Image

Occurences in reactions

MNX_ID

MNXM107212

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₂₀H₁₈O₄

charge

mass

322.12051

reference

InChIKey

OBGPEBYHGIUFBN-UHFFFAOYSA-N

InChI

InChI=1S/C20H18O4/c1-12(2)3-4-14-9-13(5-8-18(14)22)17-11-24-19-10-15(21)6-7-16(19)20(17)23/h3,5-11,21-22H,4H2,1-2H3

SMILES

CC(C)=CCc1cc(-c2coc3cc(O)ccc3c2=O)ccc1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:66614 chebi:66614	neobavaisoflavone 7,4'-dihydroxy-3'-(3-methyl-buten-2-yl)isoflavone 7,4'-dihydroxy-3'-(gamma,gamma-dimethylallyl)isoflavone 7-hydroxy-3-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-4H-1-benzopyran-4-one 7-hydroxy-3-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]-4H-chromen-4-one
lipidmaps:LMPK12050027 lipidmapsM:LMPK12050027	Neobavaisoflavone