Glycoside
GD029278
Name:
NoneFormula:
C32H41O4N7Smiles:
COC[C@@H]1O[C@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(NCCN4CCCCC4)nc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(nc(NCCN3CCCCC3)nc2NCC(c2ccccc2)c2ccccc2)[N]1Sugarmoiety:
COCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | 3.23 | Num_rotatable_bonds: | 12 |
| MolWt: | 587.73 | Num_heavy_atoms: | 43 |
| TPSA: | 129.82 | NumAromaticRings: | 4 |
Unique Aglycone
AD12939
Formula: C26H30N7
Smiles:
C1=Nc2c(nc(NCCN3CCCCC3)nc2NCC(c2ccccc2)c2ccccc2)[N]1| HBA: | 7 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.35 |
| AlogP: | 4.53 | Num_rotatable_bonds: | 9 |
| MolWt: | 440.58 | Num_heavy_atoms: | 33 |
| TPSA: | 79.54 | NumAromaticRings: | 3 |
