Glycoside
GD000629
Name:
NoneFormula:
C18H21O7NSSmiles:
CC(=S)NC1C(Oc2ccc3c(C)cc(=O)oc3c2)OC(CO)C(O)C1OAglycone:
Cc1cc(=O)oc2cc(O)ccc12Sugarmoiety:
CC(=S)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | 0.22 | Num_rotatable_bonds: | 4 |
| MolWt: | 395.43 | Num_heavy_atoms: | 27 |
| TPSA: | 121.39 | NumAromaticRings: | 2 |
Unique Aglycone
AD00685
Formula: C10H8O3
Smiles:
Cc1cc(=O)oc2cc(O)ccc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 1.81 | Num_rotatable_bonds: | 0 |
| MolWt: | 176.17 | Num_heavy_atoms: | 13 |
| TPSA: | 50.44 | NumAromaticRings: | 2 |
