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cyclodopa 5-beta-D-glucoside

Properties

Image

Occurences in reactions

MNX_ID

MNXM4540

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	0

formula

C₁₅H₁₉NO₉

charge

mass

357.10598

reference

chebi:134458

InChIKey

PXMFPPFHRQZIHO-OLCQZNMOSA-N

InChI

InChI=1S/C15H19NO9/c17-4-10-11(19)12(20)13(21)15(25-10)24-9-2-5-1-7(14(22)23)16-6(5)3-8(9)18/h2-3,7,10-13,15-21H,1,4H2,(H,22,23)/t7-,10+,11+,12-,13+,15+/m0/s1

SMILES

O=C(O)[C@@H]1Cc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2N1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:134458 chebi:134458	cyclodopa 5-beta-D-glucoside (2S)-5-(beta-D-glucopyranosyloxy)-6-hydroxy-2,3-dihydro-1H-indole-2-carboxylic acid Cyclodopa glucoside cyclo-Dopa 5-O-glucoside leucodopachrome 5-beta-D-glucoside leucodopachrome glucoside
kegg.compound:C17751 keggC:C17751	cyclo-Dopa 5-O-glucoside
seed.compound:cpd17848 seedM:cpd17848	cyclo-Dopa 5-O-glucoside cyclo-dopa 5-O-glucoside
metacyc.compound:CPD-8656 metacycM:CPD-8656	cyclo-dopa 5-O-glucoside
chebi:81316 keggC:M_C17751 seedM:M_cpd17848	secondary/obsolete/fantasy identifier