Glycoside
GD024330
Name:
NoneFormula:
C20H26O11N2Smiles:
O=C(O)CNC(=O)C(CC1OC(CO)C(O)C(O)C1O)N(CC(=O)O)C(=O)c1ccccc1Aglycone:
CC(C(=O)NCC(=O)O)N(CC(=O)O)C(=O)c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -2.98 | Num_rotatable_bonds: | 10 |
| MolWt: | 470.43 | Num_heavy_atoms: | 33 |
| TPSA: | 214.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD16256
Formula: C14H16O6N2
Smiles:
CC(C(=O)NCC(=O)O)N(CC(=O)O)C(=O)c1ccccc1| HBA: | 8 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 7 |
| MolWt: | 308.29 | Num_heavy_atoms: | 22 |
| TPSA: | 124.01 | NumAromaticRings: | 1 |
