Glycoside
GD004888
Name:
NoneFormula:
C23H31O12NSmiles:
CC(=Cc1ccc(O[C@@H]2O[C@H](C(C)O)[C@H](O)[C@H]2O)c(O)c1)C(=O)N[C@@H]1[C@H](O)[C@H](O)[C@@H]2OCO[C@H]2[C@H]1OAglycone:
CC(=Cc1ccc(O)c(O)c1)C(=O)NC1C(O)C(O)C2OCOC2C1OSugarmoiety:
CC(O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.61 |
| AlogP: | -2.68 | Num_rotatable_bonds: | 6 |
| MolWt: | 513.5 | Num_heavy_atoms: | 36 |
| TPSA: | 207.63 | NumAromaticRings: | 1 |
Unique Aglycone
AD00098
Formula: C17H21O8N
Smiles:
CC(=Cc1ccc(O)c(O)c1)C(=O)NC1C(O)C(O)C2OCOC2C1O| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.47 |
| AlogP: | -1.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 367.35 | Num_heavy_atoms: | 26 |
| TPSA: | 148.71 | NumAromaticRings: | 1 |
