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narirutin

MNXM64262 is deprecated and here replaced by MNXM739115
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM739115

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₂₇H₃₂O₁₄

charge

mass

580.17921

reference

chebi:28705

InChIKey

HXTFHSYLYXVTHC-AJHDJQPGSA-N

InChI

InChI=1S/C27H32O14/c1-10-20(31)22(33)24(35)26(38-10)37-9-18-21(32)23(34)25(36)27(41-18)39-13-6-14(29)19-15(30)8-16(40-17(19)7-13)11-2-4-12(28)5-3-11/h2-7,10,16,18,20-29,31-36H,8-9H2,1H3/t10-,16-,18+,20-,21+,22+,23-,24+,25+,26+,27+/m0/s1

SMILES

C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc(O)c4c(c3)O[C@H](c3ccc(O)cc3)CC4=O)[C@H](O)[C@@H](O)[C@@H]2O)[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
CHEBI:28705 chebi:28705	narirutin (2S)-5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-chromen-7-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside Isonaringenin Isonaringin Naringenin 7-O-rutinoside Narirutin
kegg.compound:C09793 keggC:C09793	Narirutin Naringenin 7-O-rutinoside
seed.compound:cpd06685 seedM:cpd06685	Narirutin Naringenin 7-O-rutinoside naringenin-7-O-rutinoside narirutin
metacyc.compound:CPD-7059 metacycM:CPD-7059	narirutin naringenin-7-O-rutinoside
chebi:25489 chebi:7486 keggC:M_C09793 seedM:M_cpd06685	secondary/obsolete/fantasy identifier