Glycoside
GD015348
Name:
NoneFormula:
C29H23O10N5Smiles:
N#CCC(=O)NN1C(=O)c2c(c3c4cccc(O)c4n(C4OC(CO)C(O)C(O)C4O)c3c3[nH]c4c(O)cccc4c23)C1=OAglycone:
N#CCC(=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: | 15 | RingCount: | 7 |
| HBD: | 8 | FractionCSP3: | 0.24 |
| AlogP: | 0.35 | Num_rotatable_bonds: | 4 |
| MolWt: | 601.53 | Num_heavy_atoms: | 44 |
| TPSA: | 241.6 | NumAromaticRings: | 5 |
Unique Aglycone
AD11164
Formula: C23H13O5N5
Smiles:
N#CCC(=O)NN1C(=O)c2c(c3c4cccc(O)c4[nH]c3c3[nH]c4c(O)cccc4c23)C1=O| HBA: | 10 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.04 |
| AlogP: | 2.91 | Num_rotatable_bonds: | 2 |
| MolWt: | 439.39 | Num_heavy_atoms: | 33 |
| TPSA: | 162.31 | NumAromaticRings: | 5 |
