Isoquercitrin 4''-rhamnoside

Properties Image MNX_ID MNXM126950 reference hmdb:HMDB0040489 formula C27H30O16 global charge 0 mol weight 610.521 InChIKey SKOCCRDVSSOREC-UHFFFAOYSA-N InChI InChI=1S/C27H30O16/c1-8-17(33)19(35)21(37)26(39-8)42-24-15(7-28)41-27(22(38)20(24)36)43-25-18(34)16-13(32)5-10(29)6-14(16)40-23(25)9-2-3-11(30)12(31)4-9/h2-6,8,15,17,19-22,24,26-33,35-38H,7H2,1H3 SMILES CC1OC(OC2C(CO)OC(OC3=C(C4=CC(O)=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)C(O)C2O)C(O)C(O)C1O MNX internals InChI (mnx) InChI=1/C27H30O16/c1-8-17(33)19(35)21(37)26(39-8)42-24-15(7-28)41-27(22(38)20(24)36)43-25-18(34)16-13(32)5-10(29)6-14(16)40-23(25)9-2-3-11(30)12(31)4-9/h2-6,8,15,17,19-22,24,26-33,35-38H,7H2,1H3/t8?,15?,17?,19?,20?,21?,22?,24?,26?,27? SMILES (mnx) [CH3:1][CH:8]1[CH:17]([OH:33])[CH:19]([OH:35])[CH:21]([OH:37])[CH:26]([O:42][CH:24]2[CH:15]([CH2:7][OH:28])[O:41][CH:27]([O:43][C:25]3=[C:23]([C:9]4=[CH:4][C:12]([OH:31])=[C:11]([OH:30])[CH:3]=[CH:2]4)[O:40][C:14]4=[CH:6][C:10]([OH:29])=[CH:5][C:13]([OH:32])=[C:16]4[C:18]3=[O:34])[CH:22]([OH:38])[CH:20]2[OH:36])[O:39]1

Parent-child relations graph

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