Glycoside
GD000152
Name:
NoneFormula:
C25H33O15NSmiles:
CC(CC(=O)CO[C@@H]1[C@H](O)[C@H](O)[C@H](O)[C@@H]2NC(=O)c3c(cc4c(c3O)OCO4)[C@@H]12)OC1OC(CO)C(O)C(O)C1OAglycone:
CC(O)CC(=O)COC1C(O)C(O)C(O)C2NC(=O)c3c(cc4c(c3O)OCO4)C21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.68 |
| AlogP: | -4.04 | Num_rotatable_bonds: | 8 |
| MolWt: | 587.53 | Num_heavy_atoms: | 41 |
| TPSA: | 254.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD00186
Formula: C19H23O10N
Smiles:
CC(O)CC(=O)COC1C(O)C(O)C(O)C2NC(=O)c3c(cc4c(c3O)OCO4)C21| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.58 |
| AlogP: | -1.86 | Num_rotatable_bonds: | 5 |
| MolWt: | 425.39 | Num_heavy_atoms: | 30 |
| TPSA: | 175.01 | NumAromaticRings: | 1 |
