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trans-astringin

MNXM16184 is deprecated and here replaced by MNXM730174
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM730174 Image of MNXM730174
referencechebi:2899
formulaC20H22O9
global charge0
mol weight406.387
InChIKeyPERPNFLGJXUDDW-CUYWLFDKSA-N
InChIInChI=1S/C20H22O9/c21-9-16-17(25)18(26)19(27)20(29-16)28-13-6-11(5-12(22)8-13)2-1-10-3-4-14(23)15(24)7-10/h1-8,16-27H,9H2/b2-1+/t16-,17-,18+,19-,20-/m1/s1
SMILESOC[C@H]1O[C@@H](OC2=CC(O)=CC(/C=C/C3=CC=C(O)C(O)=C3)=C2)[C@H](O)[C@@H](O)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C20H22O9/c21-9-16-17(25)18(26)19(27)20(29-16)28-13-6-11(5-12(22)8-13)2-1-10-3-4-14(23)15(24)7-10/h1-8,16-27H,9H2/b2-1+/t16-,17-,18+,19-,20-/m1/s1 Image of MNXM730174
SMILES (mnx)[CH:1](=[CH:2]/[C:11]1=[CH:5][C:12]([OH:22])=[CH:8][C:13]([O:28][C@H:20]2[C@H:19]([OH:27])[C@@H:18]([OH:26])[C@H:17]([OH:25])[C@@H:16]([CH2:9][OH:21])[O:29]2)=[CH:6]1)\[C:10]1=[CH:7][C:15]([OH:24])=[C:14]([OH:23])[CH:4]=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:2899
chebi:2899
PERPNFLGJXUDDW-CUYWLFDKSA-N 		trans-astringin
(E)-Astringin
3,4,3',5'-Tetrahydroxystilbene 3'-glucoside
3-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-5-hydroxyphenyl beta-D-glucopyranoside
Astringin
piceatannol 3-O-beta-D-glucoside
piceatannol 3-beta-D-glucoside
piceatannol 3-beta-glucoside

kegg.compound:C10245
keggC:C10245
lipidmaps:LMPK13090007
lipidmapsM:LMPK13090007
PERPNFLGJXUDDW-CUYWLFDKSA-N 		Astringin

keggC:M_C10245 		secondary/obsolete/fantasy identifier