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

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Glyzaglabrin

MNXM34241 is deprecated and here replaced by MNXM1369167
!!! Alternative mappings exist !!!

	Properties	Image
MNX_ID	MNXM1369167
reference	chebi:174835
formula	C₁₆H₁₀O₆
global charge	0
mol weight	298.25
InChIKey	GRMSSCUVELGNHC-UHFFFAOYSA-N
InChI	InChI=1S/C16H10O6/c17-8-1-2-10-13(5-8)20-6-11(14(10)18)9-3-4-12-16(15(9)19)22-7-21-12/h1-6,17,19H,7H2
SMILES	O=C1C(C2=CC=C3OCOC3=C2O)=COC2=C1C=CC(O)=C2

MNX internals

InChI (mnx)	InChI=1/C16H10O6/c17-8-1-2-10-13(5-8)20-6-11(14(10)18)9-3-4-12-16(15(9)19)22-7-21-12/h1-6,17,19H,7H2
SMILES (mnx)	[CH:1]1=[CH:2][C:10]2=[C:13]([CH:5]=[C:8]1[OH:17])[O:20][CH:6]=[C:11]([C:9]1=[C:15]([OH:19])[C:16]3=[C:12]([CH:4]=[CH:3]1)[O:21][CH2:7][O:22]3)[C:14]2=[O:18]

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:174835 chebi:174835 GRMSSCUVELGNHC-UHFFFAOYSA-N	Glyzaglabrin 7-hydroxy-3-(4-hydroxy-1,3-benzodioxol-5-yl)chromen-4-one
kegg.compound:C03662 keggC:C03662 GRMSSCUVELGNHC-UHFFFAOYSA-N	2'-Hydroxypseudobaptigenin
hmdb:HMDB0033859 GRMSSCUVELGNHC-UHFFFAOYSA-N	Glyzaglabrin 2',7-Dihydroxy-3',4'-methylenedioxyisoflavone 7,2'-Dihydroxy-3',4'-methylenedioxyisoflavone 7-hydroxy-3-(4-hydroxy-2H-1,3-benzodioxol-5-yl)-4H-chromen-4-one glyzaglabrin
lipidmaps:LMPK12050085 lipidmapsM:LMPK12050085 GRMSSCUVELGNHC-UHFFFAOYSA-N	Glyzaglabrin 7,2'-Dihydroxy-3',4'-methylenedioxyisoflavone
hmdb:HMDB33859 keggC:M_C03662	secondary/obsolete/fantasy identifier