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deoxyhumulone

Properties

Image

Occurences in reactions

MNX_ID

MNXM11406

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	0

formula

C₂₁H₃₀O₄

charge

mass

346.21441

reference

InChIKey

NQYBQBZOHCACCR-UHFFFAOYSA-N

InChI

InChI=1S/C21H30O4/c1-12(2)7-9-15-19(23)16(10-8-13(3)4)21(25)18(20(15)24)17(22)11-14(5)6/h7-8,14,23-25H,9-11H2,1-6H3

SMILES

CC(C)=CCc1c(O)c(CC=C(C)C)c(O)c(C(=O)CC(C)C)c1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:134345 chebi:134345	deoxyhumulone 3,5-Bis(3-methyl-2-butenyl)phlorisovalerophenone 3,5-diprenylphlorisovalerophenone 4-Deoxy-humulone 4-Deoxyhumulone diprenylphlorisovalerophenone
hmdb:HMDB0036624	4-Deoxyhumulone 3,5-Bis(3-methyl-2-butenyl)phlorisovalerophenone 3,5-Bis(3-methyl-2-butenyl)phloroisovalerophenone 3,5-Diprenylphlorisovalerophenone 3-Methyl-1-[2,4,6-trihydroxy-3,5-bis(3-methyl-2-butenyl)phenyl]-1-butanone, 9ci 3-methyl-1-[2,4,6-trihydroxy-3,5-bis(3-methylbut-2-en-1-yl)phenyl]butan-1-one 4-Deoxy-humulone Deoxyhumulone Diprenylphlorisovalerophenone
metacyc.compound:CPD-7105 metacycM:CPD-7105 seed.compound:cpd24710 seedM:cpd24710	deoxyhumulone diprenylphlorisovalerophenone
hmdb:HMDB36624 seedM:M_cpd24710	secondary/obsolete/fantasy identifier