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Genistein 7-O-apiosyl-(1->6)-glucoside

PropertiesImage
MNX_IDMNXM54861 Image of MNXM54861
referencechebi:184588
formulaC26H28O14
global charge0
mol weight564.496
InChIKeyUXJMURXRQMFKJC-JEQMPJCPSA-N
InChIInChI=1S/C26H28O14/c27-9-26(35)10-38-25(23(26)34)37-8-17-20(31)21(32)22(33)24(40-17)39-13-5-15(29)18-16(6-13)36-7-14(19(18)30)11-1-3-12(28)4-2-11/h1-7,17,20-25,27-29,31-35H,8-10H2/t17-,20-,21+,22-,23+,24-,25-,26-/m1/s1
SMILESO=C1C(C2=CC=C(O)C=C2)=COC2=CC(O[C@@H]3O[C@H](CO[C@@H]4OC[C@](O)(CO)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)=CC(O)=C12
MNX internals
InChI (mnx)InChI=1/C26H28O14/c27-9-26(35)10-38-25(23(26)34)37-8-17-20(31)21(32)22(33)24(40-17)39-13-5-15(29)18-16(6-13)36-7-14(19(18)30)11-1-3-12(28)4-2-11/h1-7,17,20-25,27-29,31-35H,8-10H2/t17-,20-,21+,22-,23+,24-,25-,26-/m1/s1 Image of MNXM54861
SMILES (mnx)[CH:1]1=[CH:3][C:12]([OH:28])=[CH:4][CH:2]=[C:11]1[C:14]1=[CH:7][O:36][C:16]2=[CH:6][C:13]([O:39][C@H:24]3[C@H:22]([OH:33])[C@@H:21]([OH:32])[C@H:20]([OH:31])[C@@H:17]([CH2:8][O:37][C@H:25]4[C@H:23]([OH:34])[C@:26]([CH2:9][OH:27])([OH:35])[CH2:10][O:38]4)[O:40]3)=[CH:5][C:15]([OH:29])=[C:18]2[C:19]1=[O:30]
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:184588
chebi:184588
UXJMURXRQMFKJC-JEQMPJCPSA-N
Genistein 7-O-apiosyl-(1->6)-glucoside
7-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-3-(4-hydroxyphenyl)chromen-4-one

lipidmaps:LMPK12050175
lipidmapsM:LMPK12050175
UXJMURXRQMFKJC-JEQMPJCPSA-N
Genistein 7-O-apiosyl-(1->6)-glucoside
Ambocin