Glycoside
GD003053
Name:
NoneFormula:
C21H36O11N4Smiles:
CCOC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)OC1C(O)C(CO)OC(O)C1NC(C)=OAglycone:
CCOC(=O)C(CCC(N)=O)NC(=O)C(C)NC(=O)C(C)OSugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.76 |
| AlogP: | -3.85 | Num_rotatable_bonds: | 13 |
| MolWt: | 520.54 | Num_heavy_atoms: | 36 |
| TPSA: | 235.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD02815
Formula: C13H23O6N3
Smiles:
CCOC(=O)C(CCC(N)=O)NC(=O)C(C)NC(=O)C(C)O| HBA: | 9 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.69 |
| AlogP: | -1.81 | Num_rotatable_bonds: | 9 |
| MolWt: | 317.34 | Num_heavy_atoms: | 22 |
| TPSA: | 147.82 | NumAromaticRings: | 0 |
