Glycoside
GD007876
Name:
NoneFormula:
C23H45O7N5Smiles:
CN[C@@H]1[C@H](O)[C@H](O[C@H]2[C@H](N)C[C@@H](N)[C@@H](O[C@@H]3OC(CNC(C)(C)C)=CC[C@H]3N)[C@H]2O)OC[C@]1(C)OAglycone:
CC(C)(C)NCC1=CCC(N)C(OC2C(N)CC(N)C(O)C2O)O1Sugarmoiety:
CNC1C(O)C(O)OCC1(C)OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 11 | FractionCSP3: | 0.91 |
| AlogP: | -2.42 | Num_rotatable_bonds: | 7 |
| MolWt: | 503.64 | Num_heavy_atoms: | 35 |
| TPSA: | 199.73 | NumAromaticRings: | 0 |
Unique Aglycone
AD06364
Formula: C16H32O4N4
Smiles:
CC(C)(C)NCC1=CCC(N)C(OC2C(N)CC(N)C(O)C2O)O1| HBA: | 8 | RingCount: | 2 |
| HBD: | 9 | FractionCSP3: | 0.88 |
| AlogP: | -1.5 | Num_rotatable_bonds: | 4 |
| MolWt: | 344.46 | Num_heavy_atoms: | 24 |
| TPSA: | 149.01 | NumAromaticRings: | 0 |
