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nodakenetin

MNXM3757 is deprecated and here replaced by MNXM735082
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM735082

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

formula

C₁₄H₁₄O₄

charge

mass

246.08921

reference

InChIKey

FWYSBEAFFPBAQU-GFCCVEGCSA-N

InChI

InChI=1S/C14H14O4/c1-14(2,16)12-6-9-5-8-3-4-13(15)18-10(8)7-11(9)17-12/h3-5,7,12,16H,6H2,1-2H3/t12-/m1/s1

SMILES

CC(C)(O)[C@H]1Cc2cc3ccc(=O)oc3cc2O1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:132623 chebi:132623	nodakenetin (-)-Marmesin (2R)-2-(1-hydroxy-1-methylethyl)-2,3-dihydro-7H-furo[3,2-g]chromen-7-one (R)-2-(1-Hydroxy-1-methylethyl)-2,3-dihydro-7H-furo(3,2-g)(1)benzopyran-7-one
hmdb:HMDB0030786	Marmesin (+)-Marmesin (S)-Marmesin 2-(2-hydroxypropan-2-yl)-2H,3H,7H-furo[3,2-g]chromen-7-one S-(+)-Marmesin marmesin
seed.compound:cpd06173 seedM:cpd06173 kegg.compound:C09278 keggC:C09278	Nodakenetin (-)-Marmesin
CHEBI:49080 chebi:49080	marmesin 2-(1-hydroxy-1-methylethyl)-2,3-dihydro-7H-furo[3,2-g]chromen-7-one
hmdb:HMDB30786 chebi:49083 chebi:7606 keggC:M_C09278 seedM:M_cpd06173	secondary/obsolete/fantasy identifier