Glycoside
GD000566
Name:
NoneFormula:
C28H24O10N4Smiles:
CC(=O)NN1C(=O)c2c(c3c4cccc(O)c4n(C4OC(CO)C(O)C(O)C4O)c3c3[nH]c4c(O)cccc4c23)C1=OAglycone:
CC(=O)NN1C(=O)c2c(c3c4cccc(O)c4[nH]c3c3[nH]c4c(O)cccc4c23)C1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 7 |
| HBD: | 8 | FractionCSP3: | 0.25 |
| AlogP: | 0.46 | Num_rotatable_bonds: | 3 |
| MolWt: | 576.52 | Num_heavy_atoms: | 42 |
| TPSA: | 217.81 | NumAromaticRings: | 5 |
Unique Aglycone
AD00617
Formula: C22H14O5N4
Smiles:
CC(=O)NN1C(=O)c2c(c3c4cccc(O)c4[nH]c3c3[nH]c4c(O)cccc4c23)C1=O| HBA: | 9 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.05 |
| AlogP: | 3.01 | Num_rotatable_bonds: | 1 |
| MolWt: | 414.38 | Num_heavy_atoms: | 31 |
| TPSA: | 138.52 | NumAromaticRings: | 5 |
