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Tuberonic acid glucoside

MNXM95969 is deprecated and here replaced by MNXM741628
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM741628

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₁₈H₂₈O₉

charge

mass

388.17333

reference

keggC:C08558

InChIKey

JFDNMLUPLXZXGV-RKAGECJXSA-N

InChI

InChI=1S/C18H28O9/c19-9-13-15(23)16(24)17(25)18(27-13)26-7-3-1-2-4-11-10(8-14(21)22)5-6-12(11)20/h1-2,10-11,13,15-19,23-25H,3-9H2,(H,21,22)/b2-1-/t10-,11-,13-,15-,16+,17-,18-/m1/s1

SMILES

O=C(O)C[C@H]1CCC(=O)[C@@H]1C/C=C\CCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
kegg.compound:C08558 keggC:C08558	Tuberonic acid glucoside
seed.compound:cpd05465 seedM:cpd05465	Tuberonic acid glucoside 12-hydroxyjasmonic acid 12-O-beta-D-glucoside trans-12-hydroxyjasmonate 12-O-beta-D-glucoside trans-tuberonic acid glucoside tuberonic acid glucoside
metacyc.compound:CPD-11510 metacycM:CPD-11510	trans-tuberonic acid glucoside trans-12-hydroxyjasmonate 12-O-beta-D-glucoside
keggC:M_C08558 seedM:M_cpd05465	secondary/obsolete/fantasy identifier