Glycoside
GD003186
Name:
NoneFormula:
C20H21O6N5Smiles:
OC[C@@H]1O[C@H](n2cnc3c(NC4CCc5cc6c(cc54)OCO6)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(ncnc2NC2CCc3cc4c(cc32)OCO4)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | 0.27 | Num_rotatable_bonds: | 4 |
| MolWt: | 427.42 | Num_heavy_atoms: | 31 |
| TPSA: | 144.01 | NumAromaticRings: | 3 |
Unique Aglycone
AD02914
Formula: C15H12O2N5
Smiles:
C1=Nc2c(ncnc2NC2CCc3cc4c(cc32)OCO4)[N]1| HBA: | 7 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.27 |
| AlogP: | 2.21 | Num_rotatable_bonds: | 2 |
| MolWt: | 294.29 | Num_heavy_atoms: | 22 |
| TPSA: | 82.73 | NumAromaticRings: | 2 |
