eugenol beta-primeveroside

Properties Image MNX_ID MNXM17602 reference metacycM:CPD-14737 formula C21H30O11 global charge 0 mol weight 458.46 InChIKey FSCNUJMKSQHQSY-OSLYEKKFSA-N InChI InChI=1S/C21H30O11/c1-3-4-10-5-6-12(13(7-10)28-2)31-21-19(27)17(25)16(24)14(32-21)9-30-20-18(26)15(23)11(22)8-29-20/h3,5-7,11,14-27H,1,4,8-9H2,2H3/t11-,14-,15+,16-,17+,18-,19-,20+,21-/m1/s1 SMILES C=CCC1=CC(OC)=C(O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)C=C1 MNX internals InChI (mnx) InChI=1/C21H30O11/c1-3-4-10-5-6-12(13(7-10)28-2)31-21-19(27)17(25)16(24)14(32-21)9-30-20-18(26)15(23)11(22)8-29-20/h3,5-7,11,14-27H,1,4,8-9H2,2H3/t11-,14-,15+,16-,17+,18-,19-,20+,21-/m1/s1 SMILES (mnx) [CH2:1]=[CH:3][CH2:4][C:10]1=[CH:7][C:13]([O:28][CH3:2])=[C:12]([O:31][C@H:21]2[C@H:19]([OH:27])[C@@H:17]([OH:25])[C@H:16]([OH:24])[C@@H:14]([CH2:9][O:30][C@H:20]3[C@H:18]([OH:26])[C@@H:15]([OH:23])[C@H:11]([OH:22])[CH2:8][O:29]3)[O:32]2)[CH:6]=[CH:5]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0