Glycoside
GD010191
Name:
NoneFormula:
C19H28O11N2Smiles:
CC=CC=CC(=O)N(CC(=O)O)C(CC1OC(CO)C(O)C(O)C1O)C(=O)NCC(=O)OAglycone:
CC=CC=CC(=O)N(CC(=O)O)C(C)C(=O)NCC(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.58 |
| AlogP: | -3.17 | Num_rotatable_bonds: | 11 |
| MolWt: | 460.44 | Num_heavy_atoms: | 32 |
| TPSA: | 214.16 | NumAromaticRings: | 0 |
Unique Aglycone
AD07911
Formula: C13H18O6N2
Smiles:
CC=CC=CC(=O)N(CC(=O)O)C(C)C(=O)NCC(=O)O| HBA: | 8 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.38 |
| AlogP: | -0.38 | Num_rotatable_bonds: | 8 |
| MolWt: | 298.3 | Num_heavy_atoms: | 21 |
| TPSA: | 124.01 | NumAromaticRings: | 0 |
