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Neogrifolin

Properties

Image

Occurences in reactions

MNX_ID

MNXM128642

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

formula

C₂₂H₃₂O₂

charge

mass

328.24023

reference

InChIKey

JWDIUXFSIWOGDP-VZRGJMDUSA-N

InChI

InChI=1S/C22H32O2/c1-16(2)8-6-9-17(3)10-7-11-18(4)12-13-21-19(5)14-20(23)15-22(21)24/h8,10,12,14-15,23-24H,6-7,9,11,13H2,1-5H3/b17-10+,18-12+

SMILES

CC(C)=CCC/C(C)=C/CC/C(C)=C/Cc1c(C)cc(O)cc1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:170126 chebi:170126	Neogrifolin 5-methyl-4-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]benzene-1,3-diol
hmdb:HMDB0030053	Neogrifolin 4-Farnesyl-5-methylresorcinol 4-trans,trans-Farnesyl-5-methylresorcinol 5-Methyl-6-(3,7,11-trimethyl-2,6,10-dodecatrienyl)-1,3-benzenediol 5-methyl-4-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]benzene-1,3-diol e,e,5-Methyl-4-(3,7,11-trimethyl-2,6,10-dodecatrienyl)-1,3-benzenediol
hmdb:HMDB30053	secondary/obsolete/fantasy identifier