Glycoside
GD084758
Name:
NoneFormula:
C17H24O7N2SSmiles:
C[C@@H]1O[C@@H](OCCNC(=S)Nc2ccc3c(c2)OCCO3)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
OCCNC(=S)Nc1ccc2c(c1)OCCO2Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.59 |
| AlogP: | -0.41 | Num_rotatable_bonds: | 5 |
| MolWt: | 400.45 | Num_heavy_atoms: | 27 |
| TPSA: | 121.67 | NumAromaticRings: | 1 |
Unique Aglycone
AD37903
Formula: C11H14O3N2S
Smiles:
OCCNC(=S)Nc1ccc2c(c1)OCCO2| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.36 |
| AlogP: | 0.74 | Num_rotatable_bonds: | 3 |
| MolWt: | 254.31 | Num_heavy_atoms: | 17 |
| TPSA: | 62.75 | NumAromaticRings: | 1 |
