Search MNXref
 Feedback

bracteatin 6-O-beta-glucoside

MNXM8346 is deprecated and here replaced by MNXM1369536
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1369536 Image of MNXM1369536
referencechebi:66907
formulaC21H20O12
global charge0
mol weight464.379
InChIKeySFXSFWVZPKEDPA-LNCSSOGTSA-N
InChIInChI=1S/C21H20O12/c22-6-14-18(28)19(29)20(30)21(33-14)31-8-4-9(23)15-12(5-8)32-13(17(15)27)3-7-1-10(24)16(26)11(25)2-7/h1-5,14,18-26,28-30H,6H2/t14-,18-,19+,20-,21-/m1/s1
SMILESO=C1C(=CC2=CC(O)=C(O)C(O)=C2)OC2=CC(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=CC(O)=C12
MNX internals
InChI (mnx)InChI=1/C21H20O12/c22-6-14-18(28)19(29)20(30)21(33-14)31-8-4-9(23)15-12(5-8)32-13(17(15)27)3-7-1-10(24)16(26)11(25)2-7/h1-5,14,18-26,28-30H,6H2/b13-3?/t14-,18-,19+,20-,21-/m1/s1 Image of MNXM1369536
SMILES (mnx)[CH:1]1=[C:7]([CH:3]=[C:13]2[C:17](=[O:27])[C:15]3=[C:9]([OH:23])[CH:4]=[C:8]([O:31][C@H:21]4[C@H:20]([OH:30])[C@@H:19]([OH:29])[C@H:18]([OH:28])[C@@H:14]([CH2:6][OH:22])[O:33]4)[CH:5]=[C:12]3[O:32]2)[CH:2]=[C:11]([OH:25])[C:16]([OH:26])=[C:10]1[OH:24]
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:66907
chebi:66907
SFXSFWVZPKEDPA-LNCSSOGTSA-N 		bracteatin 6-O-beta-glucoside
4-hydroxy-3-oxo-2-(3,4,5-trihydroxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl beta-D-glucopyranoside
bracteatin 6-O-beta-D-glucoside

vmhM:bttn6og
vmhmetabolite:bttn6og
SFXSFWVZPKEDPA-LNCSSOGTSA-N 		Bracteatin 6-O-glucoside

lipidmaps:LMPK12130043
lipidmapsM:LMPK12130043
SFXSFWVZPKEDPA-LNCSSOGTSA-N 		Bracteatin 6-glucoside
4,6,3',4',5'-Pentahydroxyaurone 6-glucoside

vmhM:M_bttn6og 		secondary/obsolete/fantasy identifier