Glycoside
GD008483
Name:
NoneFormula:
C17H22O7N2Smiles:
O=C(O)[C@@H](Cc1c[nH]c2ccccc12)NCC(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
CNC(Cc1c[nH]c2ccccc12)C(=O)OSugarmoiety:
O=C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.41 |
| AlogP: | -1.6 | Num_rotatable_bonds: | 10 |
| MolWt: | 366.37 | Num_heavy_atoms: | 26 |
| TPSA: | 163.11 | NumAromaticRings: | 2 |
Unique Aglycone
AD06769
Formula: C12H14O2N2
Smiles:
CNC(Cc1c[nH]c2ccccc12)C(=O)O| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | 1.38 | Num_rotatable_bonds: | 4 |
| MolWt: | 218.26 | Num_heavy_atoms: | 16 |
| TPSA: | 65.12 | NumAromaticRings: | 2 |
