Glycoside
GD061426
Name:
NoneFormula:
C14H22O6N2SSmiles:
C[C@@H]1O[C@@H](OCCNC(=S)NCc2ccco2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
OCCNC(=S)NCc1ccco1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -0.91 | Num_rotatable_bonds: | 6 |
| MolWt: | 346.41 | Num_heavy_atoms: | 23 |
| TPSA: | 116.35 | NumAromaticRings: | 1 |
Unique Aglycone
AD30132
Formula: C8H12O2N2S
Smiles:
OCCNC(=S)NCc1ccco1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.38 |
| AlogP: | 0.24 | Num_rotatable_bonds: | 4 |
| MolWt: | 200.26 | Num_heavy_atoms: | 13 |
| TPSA: | 57.43 | NumAromaticRings: | 1 |
