Isorhamnetin 3-O-[b-D-glucopyranosyl-(1->2)-[a-L-rhamnopyranosyl-(1->6)]-b-D-glucopyranoside]

Properties Image MNX_ID MNXM126954 reference hmdb:HMDB0038254 formula C34H42O21 global charge 0 mol weight 786.689 InChIKey IPNYNJAPZARORI-UHFFFAOYSA-N InChI InChI=1S/C34H42O21/c1-10-20(39)24(43)27(46)32(50-10)49-9-18-22(41)26(45)31(55-33-28(47)25(44)21(40)17(8-35)52-33)34(53-18)54-30-23(42)19-14(38)6-12(36)7-16(19)51-29(30)11-3-4-13(37)15(5-11)48-2/h3-7,10,17-18,20-22,24-28,31-41,43-47H,8-9H2,1-2H3 SMILES COC1=C(O)C=CC(C2=C(OC3OC(COC4OC(C)C(O)C(O)C4O)C(O)C(O)C3OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(O)C=C3O2)=C1 MNX internals InChI (mnx) InChI=1/C34H42O21/c1-10-20(39)24(43)27(46)32(50-10)49-9-18-22(41)26(45)31(55-33-28(47)25(44)21(40)17(8-35)52-33)34(53-18)54-30-23(42)19-14(38)6-12(36)7-16(19)51-29(30)11-3-4-13(37)15(5-11)48-2/h3-7,10,17-18,20-22,24-28,31-41,43-47H,8-9H2,1-2H3/t10?,17?,18?,20?,21?,22?,24?,25?,26?,27?,28?,31?,32?,33?,34? SMILES (mnx) [CH3:1][CH:10]1[CH:20]([OH:39])[CH:24]([OH:43])[CH:27]([OH:46])[CH:32]([O:49][CH2:9][CH:18]2[CH:22]([OH:41])[CH:26]([OH:45])[CH:31]([O:55][CH:33]3[CH:28]([OH:47])[CH:25]([OH:44])[CH:21]([OH:40])[CH:17]([CH2:8][OH:35])[O:52]3)[CH:34]([O:54][C:30]3=[C:29]([C:11]4=[CH:5][C:15]([O:48][CH3:2])=[C:13]([OH:37])[CH:4]=[CH:3]4)[O:51][C:16]4=[CH:7][C:12]([OH:36])=[CH:6][C:14]([OH:38])=[C:19]4[C:23]3=[O:42])[O:53]2)[O:50]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0