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cannabichromenate

Properties

Image

Occurences in reactions

MNX_ID

MNXM8365

	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	0

formula

C₂₂H₂₉O₄

charge

-1

mass

357.20713

reference

InChIKey

HRHJHXJQMNWQTF-UHFFFAOYSA-M

InChI

InChI=1S/C22H30O4/c1-5-6-7-10-16-14-18-17(20(23)19(16)21(24)25)11-13-22(4,26-18)12-8-9-15(2)3/h9,11,13-14,23H,5-8,10,12H2,1-4H3,(H,24,25)/p-1

SMILES

CCCCCc1cc2c(c(O)c1C(=O)[O-])C=CC(C)(CCC=C(C)C)O2

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:167554 chebi:167554	cannabichromenate (+)-cannabichromenate 5-hydroxy-2-methyl-2-(4-methylpent-3-en-1-yl)-7-pentyl-2H-1-benzopyran-6-carboxylate 5-hydroxy-2-methyl-2-(4-methylpent-3-en-1-yl)-7-pentyl-2H-chromene-6-carboxylate 5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-7-pentylchromene-6-carboxylate cannabichromenic acid(1-)
seed.compound:cpd24741 seedM:cpd24741	5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-7-pentyl-chromene-6-carboxylic acid CBCA cannabichromenate cannabichromenic acid
metacyc.compound:CPD-7171 metacycM:CPD-7171	cannabichromenate 5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-7-pentyl-chromene-6-carboxylic acid CBCA cannabichromenic acid
CHEBI:167557 chebi:167557	cannabichromenic acid (+)-cannabichromenic acid 5-hydroxy-2-methyl-2-(4-methylpent-3-en-1-yl)-7-pentyl-2H-1-benzopyran-6-carboxylic acid 5-hydroxy-2-methyl-2-(4-methylpent-3-en-1-yl)-7-pentyl-2H-chromene-6-carboxylic acid 5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-7-pentylchromene-6-carboxylic acid CBCA
seedM:M_cpd24741	secondary/obsolete/fantasy identifier