Glycoside
GD007197
Name:
NoneFormula:
C23H30O10N4Smiles:
NC[C@@H]1O[C@H](O[C@H](CNCc2ccc(C(=O)O)cc2)[C@@H]2C[C@H](O)[C@H](n3ccc(=O)[nH]c3=O)O2)[C@H](O)[C@H]1OAglycone:
O=C(O)c1ccc(CNCC(O)C2CC(O)C(n3ccc(=O)[nH]c3=O)O2)cc1Sugarmoiety:
NCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.52 |
| AlogP: | -2.54 | Num_rotatable_bonds: | 10 |
| MolWt: | 522.51 | Num_heavy_atoms: | 37 |
| TPSA: | 218.59 | NumAromaticRings: | 2 |
Unique Aglycone
AD05880
Formula: C18H21O7N3
Smiles:
O=C(O)c1ccc(CNCC(O)C2CC(O)C(n3ccc(=O)[nH]c3=O)O2)cc1| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | -0.97 | Num_rotatable_bonds: | 7 |
| MolWt: | 391.38 | Num_heavy_atoms: | 28 |
| TPSA: | 153.88 | NumAromaticRings: | 2 |
