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7(8),7'(8')-tetrahydrojusticidin B

Properties

Image

Occurences in reactions

MNX_ID

MNXM15012

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₂₁H₂₀O₆

charge

mass

368.12599

reference

InChIKey

LAFREGHROJJWDK-UHFFFAOYSA-N

InChI

InChI=1S/C21H20O6/c1-23-16-7-12-5-13-9-25-21(22)20(13)19(14(12)8-17(16)24-2)11-3-4-15-18(6-11)27-10-26-15/h3-4,6-8,13,19-20H,5,9-10H2,1-2H3

SMILES

COc1cc2c(cc1OC)C(c1ccc3c(c1)OCO3)C1C(=O)OCC1C2

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:CPD-13464 metacycM:CPD-13464	7(8),7'(8')-tetrahydrojusticidin B
seed.compound:cpd23893 seedM:cpd23893	7(8) 7'(8')-tetrahydrojusticidin B 7(8),7'(8')-tetrahydrojusticidin B
seedM:M_cpd23893	secondary/obsolete/fantasy identifier