MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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6-prenylnaringenin

	Properties	Image
MNX_ID	MNXM38940
reference	chebi:27566
formula	C₂₀H₂₀O₅
global charge	0
mol weight	340.375
InChIKey	YHWNASRGLKJRJJ-KRWDZBQOSA-N
InChI	InChI=1S/C20H20O5/c1-11(2)3-8-14-15(22)9-18-19(20(14)24)16(23)10-17(25-18)12-4-6-13(21)7-5-12/h3-7,9,17,21-22,24H,8,10H2,1-2H3/t17-/m0/s1
SMILES	CC(C)=CCC1=C(O)C=C2O[C@H](C3=CC=C(O)C=C3)CC(=O)C2=C1O

MNX internals

InChI (mnx)	InChI=1/C20H20O5/c1-11(2)3-8-14-15(22)9-18-19(20(14)24)16(23)10-17(25-18)12-4-6-13(21)7-5-12/h3-7,9,17,21-22,24H,8,10H2,1-2H3/t17-/m0/s1
SMILES (mnx)	[CH3:1][C:11]([CH3:2])=[CH:3][CH2:8][C:14]1=[C:20]([OH:24])[C:19]2=[C:18]([CH:9]=[C:15]1[OH:22])[O:25][C@H:17]([C:12]1=[CH:5][CH:7]=[C:13]([OH:21])[CH:6]=[CH:4]1)[CH2:10][C:16]2=[O:23]

Parent-child relations graph

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

Similar chemical compounds in external resources
Identifier	Description
CHEBI:27566 chebi:27566 YHWNASRGLKJRJJ-KRWDZBQOSA-N	6-prenylnaringenin (2S)-2,3-dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl)-6-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one sophoraflavanone B
hmdb:HMDB0037247 YHWNASRGLKJRJJ-UHFFFAOYSA-N	(S)-4',5,7-Trihydroxy-6-prenylflavanone 5,7,4'-Trihydroxy-6-prenylflavanone 5,7-dihydroxy-2-(4-hydroxyphenyl)-6-(3-methylbut-2-en-1-yl)-2,3-dihydro-1-benzopyran-4-one 5,7-dihydroxy-2-(4-hydroxyphenyl)-6-(3-methylbut-2-en-1-yl)-3,4-dihydro-2H-1-benzopyran-4-one 6-Prenylnaringenin
CHEBI:174571 chebi:174571 YHWNASRGLKJRJJ-UHFFFAOYSA-N	(S)-4',5,7-Trihydroxy-6-prenylflavanone 5,7-dihydroxy-2-(4-hydroxyphenyl)-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
lipidmaps:LMPK12140277 lipidmapsM:LMPK12140277 YHWNASRGLKJRJJ-KRWDZBQOSA-N	6-Prenylnaringenin
kegg.compound:C09832 keggC:C09832 YHWNASRGLKJRJJ-KRWDZBQOSA-N	6-Prenylnaringenin 5,7,4'-Trihydroxy-6-prenylflavanone
seed.compound:cpd06724 seedM:cpd06724 YHWNASRGLKJRJJ-KRWDZBQOSA-N	6-Prenylnaringenin 5,7,4'-Trihydroxy-6-prenylflavanone 6-prenylnaringenin
metacyc.compound:CPD-7135 metacycM:CPD-7135 YHWNASRGLKJRJJ-UHFFFAOYSA-M	6-prenylnaringenin
hmdb:HMDB37247 chebi:20756 chebi:2234 keggC:M_C09832 seedM:M_cpd06724	secondary/obsolete/fantasy identifier