Glycoside
GD003519
Name:
NoneFormula:
C24H32O10N4Smiles:
NC[C@@H]1O[C@H](O[C@H](CNCC2COc3ccccc3O2)[C@@H]2C[C@H](O)[C@H](n3ccc(=O)[nH]c3=O)O2)[C@H](O)[C@H]1OAglycone:
O=c1ccn(C2OC(C(O)CNCC3COc4ccccc4O3)CC2O)c(=O)[nH]1Sugarmoiety:
NCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.58 |
| AlogP: | -2.59 | Num_rotatable_bonds: | 9 |
| MolWt: | 536.54 | Num_heavy_atoms: | 38 |
| TPSA: | 199.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD03193
Formula: C19H23O7N3
Smiles:
O=c1ccn(C2OC(C(O)CNCC3COc4ccccc4O3)CC2O)c(=O)[nH]1| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -1.02 | Num_rotatable_bonds: | 6 |
| MolWt: | 405.41 | Num_heavy_atoms: | 29 |
| TPSA: | 135.04 | NumAromaticRings: | 2 |
