Glycoside
GD000198
Name:
NoneFormula:
C26H50O10N6Smiles:
CN[C@@H]1[C@H](O)[C@@](C)(O[C@H]2[C@H](NC(=O)[C@H](O)CCN)C[C@@H](N)[C@@H](O[C@@H]3OC(CNCCO)=CC[C@H]3N)[C@H]2O)OC[C@]1(C)OAglycone:
NCCC(O)C(=O)NC1CC(N)C(OC2OC(CNCCO)=CCC2N)C(O)C1OSugarmoiety:
CNC1C(O)C(C)(O)OCC1(C)OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 3 |
| HBD: | 14 | FractionCSP3: | 0.88 |
| AlogP: | -4.97 | Num_rotatable_bonds: | 13 |
| MolWt: | 606.72 | Num_heavy_atoms: | 42 |
| TPSA: | 269.29 | NumAromaticRings: | 0 |
Unique Aglycone
AD00234
Formula: C18H35O7N5
Smiles:
NCCC(O)C(=O)NC1CC(N)C(OC2OC(CNCCO)=CCC2N)C(O)C1O| HBA: | 12 | RingCount: | 2 |
| HBD: | 12 | FractionCSP3: | 0.83 |
| AlogP: | -4.44 | Num_rotatable_bonds: | 10 |
| MolWt: | 433.51 | Num_heavy_atoms: | 30 |
| TPSA: | 218.57 | NumAromaticRings: | 0 |
