Glycoside
GD154091
Name:
6-C-Arabinopyranosyl-8-C-GlucopyranosyltricinFormula:
C28H32O16Smiles:
COc1cc(-c2cc(=O)c3c(O)c(C4OCC(O)C(O)C4O)c(O)c(C4OC(CO)C(O)C(O)C4O)c3o2)cc(OC)c1OAglycone:
COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc(OC)c1OSugarmoiety:
OC1COC(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 10 | FractionCSP3: | 0.46 |
| AlogP: | -1.74 | Num_rotatable_bonds: | 6 |
| MolWt: | 624.55 | Num_heavy_atoms: | 44 |
| TPSA: | 269.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD08658
Formula: C17H14O7
Smiles:
COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc(OC)c1O| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.12 |
| AlogP: | 2.59 | Num_rotatable_bonds: | 3 |
| MolWt: | 330.29 | Num_heavy_atoms: | 24 |
| TPSA: | 109.36 | NumAromaticRings: | 3 |
