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narirutin

MNXM64262 is deprecated and here replaced by MNXM1371984
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1371984 Image of MNXM1371984
referencechebi:28705
formulaC27H32O14
global charge0
mol weight580.539
InChIKeyHXTFHSYLYXVTHC-AJHDJQPGSA-N
InChIInChI=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
SMILESC[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(C(=O)C[C@@H](C5=CC=C(O)C=C5)O4)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
MNX internals
InChI (mnx)InChI=1/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 Image of MNXM1371984
SMILES (mnx)[CH3:1][C@H:10]1[C@H:20]([OH:31])[C@@H:22]([OH:33])[C@@H:24]([OH:35])[C@H:26]([O:37][CH2:9][C@@H:18]2[C@@H:21]([OH:32])[C@H:23]([OH:34])[C@@H:25]([OH:36])[C@H:27]([O:39][C:13]3=[CH:6][C:14]([OH:29])=[C:19]4[C:15](=[O:30])[CH2:8][C@@H:16]([C:11]5=[CH:3][CH:5]=[C:12]([OH:28])[CH:4]=[CH:2]5)[O:40][C:17]4=[CH:7]3)[O:41]2)[O:38]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:28705
chebi:28705
HXTFHSYLYXVTHC-AJHDJQPGSA-N 		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

lipidmaps:LMPK12140236
lipidmapsM:LMPK12140236
HXTFHSYLYXVTHC-AJHDJQPGSA-N 		Narirutin
Isonaringin
Naringenin 7-O-rutinoside

kegg.compound:C09793
keggC:C09793
HXTFHSYLYXVTHC-AJHDJQPGSA-N 		Narirutin
Naringenin 7-O-rutinoside

seed.compound:cpd06685
seedM:cpd06685
HXTFHSYLYXVTHC-AJHDJQPGSA-N 		Narirutin
Naringenin 7-O-rutinoside
naringenin-7-O-rutinoside
narirutin

metacyc.compound:CPD-7059
metacycM:CPD-7059
HXTFHSYLYXVTHC-AJHDJQPGSA-N 		narirutin
naringenin-7-O-rutinoside

chebi:25489
chebi:7486
keggC:M_C09793
seedM:M_cpd06685 		secondary/obsolete/fantasy identifier