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glyceollin I

MNXM3283 is deprecated and here replaced by MNXM734168
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM734168

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

formula

C₂₀H₁₈O₅

charge

mass

338.11542

reference

InChIKey

YIFYYPKWOQSCRI-AZUAARDMSA-N

InChI

InChI=1S/C20H18O5/c1-19(2)8-7-12-15(25-19)6-4-13-17(12)23-10-20(22)14-5-3-11(21)9-16(14)24-18(13)20/h3-9,18,21-22H,10H2,1-2H3/t18-,20+/m0/s1

SMILES

CC1(C)C=Cc2c(ccc3c2OC[C@@]2(O)c4ccc(O)cc4O[C@@H]32)O1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:16470 chebi:16470	glyceollin I (-)-Glyceollin I (6aS,11aS)-2,2-dimethyl-2H,6H-[1]benzofuro[3,2-c]pyrano[2,3-h]chromene-6a,9(11aH)-diol Glyceollin glyceollin
lipidmaps:LMPK12070123 lipidmapsM:LMPK12070123	(-)-Glyceollin I
kegg.compound:C01701 keggC:C01701	(-)-Glyceollin I Glyceollin
seed.compound:cpd01174 seedM:cpd01174	Glyceollin (-)-Glyceollin I (-)-glyceollin I glyceollin glyceollin I
metacyc.compound:CPD-4405 metacycM:CPD-4405	glyceollin I (-) - glyceollin I glyceollin
chebi:14332 chebi:24342 chebi:5444 keggC:M_C01701 seedM:M_cpd01174	secondary/obsolete/fantasy identifier