Glycoside
GD029752
Name:
NoneFormula:
C35H32O15Smiles:
O=C1c2c(cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c3c2O[C@H](c2ccc(O)cc2)[C@H]3c2cc(O)cc(O)c2)O[C@H](c2ccc(O)c(O)c2)[C@H]1OAglycone:
O=C1c2c(cc(O)c3c2OC(c2ccc(O)cc2)C3c2cc(O)cc(O)c2)OC(c2ccc(O)c(O)c2)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 7 |
| HBD: | 10 | FractionCSP3: | 0.29 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 6 |
| MolWt: | 692.63 | Num_heavy_atoms: | 50 |
| TPSA: | 256.29 | NumAromaticRings: | 4 |
Unique Aglycone
AD19319
Formula: C29H22O10
Smiles:
O=C1c2c(cc(O)c3c2OC(c2ccc(O)cc2)C3c2cc(O)cc(O)c2)OC(c2ccc(O)c(O)c2)C1O| HBA: | 10 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 0.14 |
| AlogP: | 3.86 | Num_rotatable_bonds: | 3 |
| MolWt: | 530.49 | Num_heavy_atoms: | 39 |
| TPSA: | 177.14 | NumAromaticRings: | 4 |
