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aureusidin 6-O-beta-glucoside

PropertiesImage
MNX_IDMNXM6181 Image of MNXM6181
referencechebi:66905
formulaC21H20O11
global charge0
mol weight448.38
InChIKeyAMJCTDBATIKENQ-YRDFTBLNSA-N
InChIInChI=1S/C21H20O11/c22-7-15-18(27)19(28)20(29)21(32-15)30-9-5-12(25)16-13(6-9)31-14(17(16)26)4-8-1-2-10(23)11(24)3-8/h1-6,15,18-25,27-29H,7H2/b14-4-/t15-,18-,19+,20-,21-/m1/s1
SMILESO=C1C2=C(O)C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C2O/C1=C\C1=CC(O)=C(O)C=C1
MNX internals
InChI (mnx)InChI=1/C21H20O11/c22-7-15-18(27)19(28)20(29)21(32-15)30-9-5-12(25)16-13(6-9)31-14(17(16)26)4-8-1-2-10(23)11(24)3-8/h1-6,15,18-25,27-29H,7H2/b14-4-/t15-,18-,19+,20-,21-/m1/s1 Image of MNXM6181
SMILES (mnx)[CH:1]1=[CH:2][C:10]([OH:23])=[C:11]([OH:24])[CH:3]=[C:8]1/[CH:4]=[C:14]1/[C:17](=[O:26])[C:16]2=[C:12]([OH:25])[CH:5]=[C:9]([O:30][C@H:21]3[C@H:20]([OH:29])[C@@H:19]([OH:28])[C@H:18]([OH:27])[C@@H:15]([CH2:7][OH:22])[O:32]3)[CH:6]=[C:13]2[O:31]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:66905
chebi:66905
AMJCTDBATIKENQ-YRDFTBLNSA-N 		aureusidin 6-O-beta-glucoside
(2Z)-2-(3,4-dihydroxybenzylidene)-4-hydroxy-3-oxo-2,3-dihydro-1-benzofuran-6-yl beta-D-glucopyranoside
2-((3,4-Dihydroxyphenyl)methylene)-6-(beta-D-glucopyranosyloxy)-4-hydroxy-3(2H)-benzofuranone
aureusidin 6-O-beta-D-glucoside

vmhM:asdn6og
vmhmetabolite:asdn6og
AMJCTDBATIKENQ-YRDFTBLNSA-N 		Aureusidin 6-O-glucoside

kegg.compound:C16409
keggC:C16409
AMJCTDBATIKENQ-YRDFTBLNSA-N 		Aureusidin 6-O-glucoside
Aureusidin 6-O-beta-D-glucoside

seed.compound:cpd15115
seedM:cpd15115
AMJCTDBATIKENQ-YRDFTBLNSA-N 		Aureusidin 6-O-glucoside
Aureusidin 6-O-beta-D-glucoside
aureusidin 6-O-glucoside

metacyc.compound:CPD-8634
metacycM:CPD-8634
AMJCTDBATIKENQ-YRDFTBLNSA-N 		aureusidin 6-O-glucoside

keggC:M_C16409
seedM:M_cpd15115
vmhM:M_asdn6og 		secondary/obsolete/fantasy identifier