Glycoside
GD054014
Name:
NoneFormula:
C12H19O7N3SSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2snnc2CO)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1snnc1COSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.75 |
| AlogP: | -2.4 | Num_rotatable_bonds: | 6 |
| MolWt: | 349.37 | Num_heavy_atoms: | 23 |
| TPSA: | 154.26 | NumAromaticRings: | 1 |
Unique Aglycone
AD27529
Formula: C6H9O3N3S
Smiles:
O=C(NCCO)c1snnc1CO| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -1.25 | Num_rotatable_bonds: | 4 |
| MolWt: | 203.22 | Num_heavy_atoms: | 13 |
| TPSA: | 95.34 | NumAromaticRings: | 1 |
