Glycoside
GD061391
Name:
NoneFormula:
C14H21O5N3SSmiles:
C[C@@H]1O[C@@H](OCCNC(=S)Nc2cccnc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
OCCNC(=S)Nc1cccnc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -0.79 | Num_rotatable_bonds: | 5 |
| MolWt: | 343.41 | Num_heavy_atoms: | 23 |
| TPSA: | 116.1 | NumAromaticRings: | 1 |
Unique Aglycone
AD30118
Formula: C8H11ON3S
Smiles:
OCCNC(=S)Nc1cccnc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | 0.36 | Num_rotatable_bonds: | 3 |
| MolWt: | 197.26 | Num_heavy_atoms: | 13 |
| TPSA: | 57.18 | NumAromaticRings: | 1 |
