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rutin

MNXM5921 is deprecated and here replaced by MNXM738596
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM738596 Image of MNXM738596
referencechebi:28527
formulaC27H30O16
global charge0
mol weight610.521
InChIKeyIKGXIBQEEMLURG-NVPNHPEKSA-N
InChIInChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1
SMILESC[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=C(C4=CC(O)=C(O)C=C4)OC4=C(C3=O)C(O)=CC(O)=C4)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
MNX internals
InChI (mnx)InChI=1/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1 Image of MNXM738596
SMILES (mnx)[CH3:1][C@H:8]1[C@H:17]([OH:32])[C@@H:20]([OH:35])[C@@H:22]([OH:37])[C@H:26]([O:39][CH2:7][C@@H:15]2[C@@H:18]([OH:33])[C@H:21]([OH:36])[C@@H:23]([OH:38])[C@H:27]([O:43][C:25]3=[C:24]([C:9]4=[CH:4][C:12]([OH:30])=[C:11]([OH:29])[CH:3]=[CH:2]4)[O:41][C:14]4=[CH:6][C:10]([OH:28])=[CH:5][C:13]([OH:31])=[C:16]4[C:19]3=[O:34])[O:42]2)[O:40]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:28527
chebi:28527
IKGXIBQEEMLURG-NVPNHPEKSA-N 		rutin
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside
3-Rhamnoglucosylquercetin
3-Rutinosyl quercetin
3-[[6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one
Phytomelin
Quercetin 3-rutinoside
Quercetin-3-rutinoside
Rutin
Rutoside
hmdb:HMDB0003249
IKGXIBQEEMLURG-NVPNHPEKSA-N 		Rutin
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-4H-chromen-4-one
3,3',4',5,7-Pentahydroxyflavone 3-O-rutinoside
3,3',4',5,7-Pentahydroxyflavone 3-rutinoside
3,3',4',5,7-Pentahydroxyflavone-3-rutinoside
3-O-Rutinosylquercetin
3-Rhamnoglucoside OF 3,3',4',5,7-pentahydroxyflavone
3-Rhamnoglucosylquercetin
3-Rhamnosyl-glucosyl quercetin
3-Rutinosyl quercetin
3-Rutinosylquercetin
3-[[6-O-(6-Deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one
3-[[6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one
5,7,3',4'-Tetrahydroxyflavonol-3-O-rutinoside
Bioflavonoid
Birutan
Birutan forte
Birutin
Eldrin
Globulariacitrin
Globularicitrin
Ilixanthin
Ilixathin
Melin
Myrticalorin
Myrticolorin
Myticolorin
Neoisorutin
Osyritrin
Oxyritin
Paliuroside
Phytomelin
Quercetin 3 rutinoside
Quercetin 3-(6-O-alpha-L-rhamnopyranosyl-beta-D-glucopyranoside)
Quercetin 3-O-alpha-L-rhamnopyranosyl-(1->6)-beta-D-glucopyranoside
Quercetin 3-O-alpha-L-rhamnopyranosyl-beta-D-glucopyranoside
Quercetin 3-O-alpha-rhamnopyranosyl(1''->6')-beta-D-glucopyranoside
Quercetin 3-O-alpha-rhamnopyranosyl(1->6)-beta-glucopyranoside
Quercetin 3-O-alpha-rhamnopyranosyl-(1'''->6'')-beta-glucopyranoside
Quercetin 3-O-beta-D-(6''-O-alpha-L-rhamnopyranosyl)glucopyranoside
Quercetin 3-O-beta-D-rutinoside
Quercetin 3-O-beta-delta-rutinoside
Quercetin 3-O-beta-rutinoside
Quercetin 3-O-rutinoside
Quercetin 3-beta-rutinoside
Quercetin 3-rhamnoglucoside
Quercetin 3-rutinoside
Quercetin 6-O-alpha-L-rhamnosyl-beta-D-glucoside
Quercetin rhamnoglucosine
Quercetin rutinoside
Quercetin, 3-rhamnosyl-glucosyl
Quercetin-3-O-[alpha-L-rhamnopyranosyl-(1->6)-beta-D-glucopyranoside]
Quercetin-3-rutinoside
Quercetin-3beta-rutinoside
Quercetol 3-rhamnoglucoside
Quercitin 3-rutinoside
RUT
Rutabion
Rutin trihydrate
Rutine
Rutinic acid
Rutinion acid
Rutinum
Rutosid
Rutoside
Rutosido
Rutosidum
Rutozid
Rutozyd
Sophorin
Tanrutin
Venoruton
Violaquercetrin
Violaquercitrin
Vitamin P
beta-Quercetin-3-rutinoside
troxerutin

lipidmaps:LMPK12112098
lipidmapsM:LMPK12112098
IKGXIBQEEMLURG-NVPNHPEKSA-N 		Rutin
3,3',4',5,7-Pentahydroxyflavone 3-rutinoside
3-Rutinosylquercetin

seed.compound:cpd03341
seedM:cpd03341
IKGXIBQEEMLURG-NVPNHPEKSA-M 		Rutin
3-[[6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]- 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one
3-[[6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one
Phytomelin
Quercetin 3-rutinoside
Quercetin-3-rutinoside
Rutoside
hydroxyethylrutoside
quercetin 3-O-[alpha-L-rhamnosyl-(1->6)-beta-D-glucoside]
quercetin 3-O-[beta-L-rhamnosyl-(1->6)-beta-D-glucoside]
quercetin 3-O-rutinoside
rutin
sophorin

kegg.compound:C05625
keggC:C05625
IKGXIBQEEMLURG-NVPNHPEKSA-N 		Rutin
3-[[6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one
Phytomelin
Quercetin 3-rutinoside
Rutoside

kegg.drug:D08499
keggD:D08499
IKGXIBQEEMLURG-NVPNHPEKSA-N 		Rutoside (INN)
Rutin
Venoruton (TN)

metacyc.compound:RUTIN
metacycM:RUTIN
IKGXIBQEEMLURG-NVPNHPEKSA-M 		rutin
hydroxyethylrutoside
quercetin 3-O-[alpha-L-rhamnosyl-(1->6)-beta-D-glucoside]
quercetin 3-O-rutinoside
sophorin

hmdb:HMDB03249
chebi:26585
chebi:45398
chebi:8923
keggC:M_C05625
keggD:M_D08499
seedM:M_cpd03341 		secondary/obsolete/fantasy identifier