Glycoside
GD132924
Name:
NoneFormula:
C27H32O17Smiles:
OCC1OC(OC2=Cc3cc(OC4OC(CO)C(O)C(O)C4O)c(O)cc3[OH+][C]2c2cc(O)c(O)c(O)c2)C(O)C(O)C1OAglycone:
OC1=Cc2cc(O)c(O)cc2[OH+]C1c1cc(O)c(O)c(O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 5 |
| HBD: | 13 | FractionCSP3: | 0.44 |
| AlogP: | -3.32 | Num_rotatable_bonds: | 7 |
| MolWt: | 628.54 | Num_heavy_atoms: | 44 |
| TPSA: | 292.48 | NumAromaticRings: | 2 |
Unique Aglycone
AD53816
Formula: C15H13O7
Smiles:
OC1=Cc2cc(O)c(O)cc2[OH+]C1c1cc(O)c(O)c(O)c1| HBA: | 7 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.07 |
| AlogP: | 2.11 | Num_rotatable_bonds: | 1 |
| MolWt: | 305.26 | Num_heavy_atoms: | 22 |
| TPSA: | 134.18 | NumAromaticRings: | 2 |
