Glycoside
GD115641
Name:
3-({3-[(6-carboxy-3,4,5-trihydroxyoxan-2-yl)oxy]-4,5-dihydroxy-6-methyloxan-2-yl}oxy)-6-{[2-({2-carboxy-4,5-dihydroxy-6-[(2,4,5-trihydroxy-6-methyloxan-3-yl)oxy]oxan-3-yl}oxy)-4,5-dihydroxy-6-methyloxan-3-yl]oxy}-4,5-dihydroxyoxane-2-carboxylic acidFormula:
C36H56O31Smiles:
CC1OC(O)C(OC2OC(C(=O)O)C(OC3OC(C)C(O)C(O)C3OC3OC(C(=O)O)C(OC4OC(C)C(O)C(O)C4OC4OC(C(=O)O)C(O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1OAglycone:
[empty]Sugarmoiety:
CC1OC(O)C(OC2OC(C(=O)O)C(OC3OC(C)C(O)C(O)C3OC3OC(C(=O)O)C(OC4OC(C)C(O)C(O)C4OC4OC(C(=O)O)C(O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 31 | RingCount: | 6 |
| HBD: | 17 | FractionCSP3: | 0.92 |
| AlogP: | -10.74 | Num_rotatable_bonds: | 13 |
| MolWt: | 984.81 | Num_heavy_atoms: | 67 |
| TPSA: | 496.65 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD04669
CC1OC(O)C(OC2OC(C(=O)O)C(OC3OC(C)C(O)C(O)C3OC3OC(C(=O)O)C(OC4OC(C)C(O)C(O)C4OC4OC(C(=O)O)C(O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O