Glycoside
GD010688
Name:
NoneFormula:
C21H29O11N3Smiles:
CCCC(=O)c1c(NOC2OCC(OC(C)=O)C(OC(C)=O)C2OC(C)=O)nc(OC)n(C)c1=OAglycone:
CCCC(=O)c1c(NO)nc(OC)n(C)c1=OSugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.62 |
| AlogP: | 0.27 | Num_rotatable_bonds: | 10 |
| MolWt: | 499.47 | Num_heavy_atoms: | 35 |
| TPSA: | 170.58 | NumAromaticRings: | 1 |
Unique Aglycone
AD08222
Formula: C10H15O4N3
Smiles:
CCCC(=O)c1c(NO)nc(OC)n(C)c1=O| HBA: | 7 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 5 |
| MolWt: | 241.25 | Num_heavy_atoms: | 17 |
| TPSA: | 93.45 | NumAromaticRings: | 1 |
