Glycoside
GD035941
Name:
NoneFormula:
C27H29O4N7Smiles:
CN1CCN(C(=O)c2cc3cc(Nc4nccc(-c5cc(OC6COCC6O)ccn5)n4)ccc3[nH]2)CC1Aglycone:
CN1CCN(C(=O)c2cc3cc(Nc4nccc(-c5cc(O)ccn5)n4)ccc3[nH]2)CC1Sugarmoiety:
OC1COCC1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 2.29 | Num_rotatable_bonds: | 6 |
| MolWt: | 515.57 | Num_heavy_atoms: | 38 |
| TPSA: | 128.73 | NumAromaticRings: | 4 |
Unique Aglycone
AD22711
Formula: C23H23O2N7
Smiles:
CN1CCN(C(=O)c2cc3cc(Nc4nccc(-c5cc(O)ccn5)n4)ccc3[nH]2)CC1| HBA: | 9 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.22 |
| AlogP: | 2.86 | Num_rotatable_bonds: | 4 |
| MolWt: | 429.48 | Num_heavy_atoms: | 32 |
| TPSA: | 110.27 | NumAromaticRings: | 4 |
