Glycoside
GD002046
Name:
NoneFormula:
C23H43O12N5Smiles:
NC[C@@H]1O[C@H](O[C@@H]2[C@H](CO)O[C@H](O[C@H]3[C@H](O[C@@H]4OC(CO)=CC[C@H]4N)[C@@H](N)C[C@@H](N)[C@H]3O)[C@H]2O)[C@H](N)[C@H](O)[C@H]1OAglycone:
NC1CC=C(CO)OC1OC1C(N)CC(N)C(O)C1OSugarmoiety:
NCC1OC(OC2C(CO)OC(O)C2O)C(N)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 4 |
| HBD: | 16 | FractionCSP3: | 0.91 |
| AlogP: | -6.68 | Num_rotatable_bonds: | 9 |
| MolWt: | 581.62 | Num_heavy_atoms: | 40 |
| TPSA: | 306.86 | NumAromaticRings: | 0 |
Unique Aglycone
AD01988
Formula: C12H23O5N3
Smiles:
NC1CC=C(CO)OC1OC1C(N)CC(N)C(O)C1O| HBA: | 8 | RingCount: | 2 |
| HBD: | 9 | FractionCSP3: | 0.83 |
| AlogP: | -2.9 | Num_rotatable_bonds: | 3 |
| MolWt: | 289.33 | Num_heavy_atoms: | 20 |
| TPSA: | 157.21 | NumAromaticRings: | 0 |
