Glycoside
GD081804
Name:
NoneFormula:
C20H29O8NSmiles:
COc1cccc(CC2(CNC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)CCOCC2)c1Aglycone:
COc1cccc(CC2(CN)CCOCC2)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.6 |
| AlogP: | -1.21 | Num_rotatable_bonds: | 10 |
| MolWt: | 411.45 | Num_heavy_atoms: | 29 |
| TPSA: | 145.55 | NumAromaticRings: | 1 |
Unique Aglycone
AD36769
Formula: C14H21O2N
Smiles:
COc1cccc(CC2(CN)CCOCC2)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.57 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 4 |
| MolWt: | 235.33 | Num_heavy_atoms: | 17 |
| TPSA: | 44.48 | NumAromaticRings: | 1 |
