Glycoside
GD007949
Name:
NoneFormula:
C26H29O4N7Smiles:
OC[C@@H]1O[C@H](n2cnc3c(Nc4ccccc4)nc(NCCC4CNc5ccccc54)nc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(nc(NCCC3CNc4ccccc43)nc2Nc2ccccc2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | 2.19 | Num_rotatable_bonds: | 8 |
| MolWt: | 503.56 | Num_heavy_atoms: | 37 |
| TPSA: | 149.61 | NumAromaticRings: | 4 |
Unique Aglycone
AD06407
Formula: C21H20N7
Smiles:
C1=Nc2c(nc(NCCC3CNc4ccccc43)nc2Nc2ccccc2)[N]1| HBA: | 7 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.19 |
| AlogP: | 4.14 | Num_rotatable_bonds: | 6 |
| MolWt: | 370.44 | Num_heavy_atoms: | 28 |
| TPSA: | 88.33 | NumAromaticRings: | 3 |
