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luteolin 7-O-neohesperidoside

MNXM8849 is deprecated and here replaced by MNXM60650
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM60650 Image of MNXM60650
referencechebi:31788
formulaC27H30O15
global charge0
mol weight594.522
InChIKeySHPPXMGVUDNKLV-KMFFXDMSSA-N
InChIInChI=1S/C27H30O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-11-5-14(31)19-15(32)7-16(40-17(19)6-11)10-2-3-12(29)13(30)4-10/h2-7,9,18,20-31,33-37H,8H2,1H3/t9-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1
SMILESC[C@@H]1O[C@@H](O[C@H]2[C@H](OC3=CC4=C(C(=O)C=C(C5=CC(O)=C(O)C=C5)O4)C(O)=C3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
MNX internals
InChI (mnx)InChI=1/C27H30O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-11-5-14(31)19-15(32)7-16(40-17(19)6-11)10-2-3-12(29)13(30)4-10/h2-7,9,18,20-31,33-37H,8H2,1H3/t9-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1 Image of MNXM60650
SMILES (mnx)[CH3:1][C@H:9]1[C@H:20]([OH:33])[C@@H:22]([OH:35])[C@@H:24]([OH:37])[C@H:26]([O:42][C@@H:25]2[C@@H:23]([OH:36])[C@H:21]([OH:34])[C@@H:18]([CH2:8][OH:28])[O:41][C@H:27]2[O:39][C:11]2=[CH:5][C:14]([OH:31])=[C:19]3[C:15](=[O:32])[CH:7]=[C:16]([C:10]4=[CH:4][C:13]([OH:30])=[C:12]([OH:29])[CH:3]=[CH:2]4)[O:40][C:17]3=[CH:6]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:31788
chebi:31788
SHPPXMGVUDNKLV-KMFFXDMSSA-N 		luteolin 7-O-neohesperidoside
2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl 2-O-(alpha-L-rhamnopyranosyl)-beta-D-glucopyranoside
7-((2-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2-(3,4-dihydroxyphenyl)-5-hydroxy-4H-1-benzopyran-4-one
Lonicerin
Luteolin 7-O-neohesperidoside
Luteolin-7-O-rhamnoside
Luteolin-7-rutinoside
Luteoline-7-rhamnoglucoside
Scolymoside
Veronicastroside

lipidmaps:LMPK12110659
lipidmapsM:LMPK12110659
SHPPXMGVUDNKLV-KMFFXDMSSA-N 		Luteolin 7-neohesperidoside
hmdb:HMDB0005799
SHPPXMGVUDNKLV-KMFFXDMSSA-N 		Scolymoside
7-((2-O-(6-Deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl)oxy)-2-(3,4-dihydroxyphenyl)-5-hydroxy-4H-1-benzopyran-4-one
7-((2-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2-(3,4-dihydroxyphenyl)-5-hydroxy-4H-1-benzopyran-4-one
7-{[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-2-(3,4-dihydroxyphenyl)-5-hydroxy-4H-chromen-4-one
Lonicerin
Loniceroside
Luteolin 7-O-beta-D-neohesperidoside
Luteolin 7-O-neohesperidoside
Luteolin 7-beta-neohesperidoside
Luteolin 7-neohesperidoside
Luteolin-7-O-rhamnoside
Luteolin-7-rutinoside
Luteolin-neohesperidoside
Luteoline-7-rhamnoglucoside
Veronicastroside
lonicerin

kegg.compound:C12630
keggC:C12630
SHPPXMGVUDNKLV-KMFFXDMSSA-N 		Scolymoside
Luteolin 7-O-neohesperidoside
Luteolin-7-O-rhamnoside
Veronicastroside

seed.compound:cpd09261
seedM:cpd09261
SHPPXMGVUDNKLV-KMFFXDMSSA-M 		Scolymoside
Luteolin 7-O-neohesperidoside
Veronicastroside
luteolin 7-O-neohesperidoside
luteolin-7-rutinoside

metacyc.compound:LUTEOLIN-7-O-NEOHESPERIDOSIDE
metacycM:LUTEOLIN-7-O-NEOHESPERIDOSIDE
SHPPXMGVUDNKLV-KMFFXDMSSA-N 		luteolin 7-O-neohesperidoside
luteolin-7-rutinoside

hmdb:HMDB05799
keggC:M_C12630
seedM:M_cpd09261 		secondary/obsolete/fantasy identifier