Glycoside
GD064415
Name:
NoneFormula:
C15H21O6N3SSmiles:
O=C([C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1O)N1C[C@@H]2CC[C@H](C1)N2c1nccs1Aglycone:
O=CN1CC2CCC(C1)N2c1nccs1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.73 |
| AlogP: | -1.88 | Num_rotatable_bonds: | 2 |
| MolWt: | 371.42 | Num_heavy_atoms: | 25 |
| TPSA: | 126.59 | NumAromaticRings: | 1 |
Unique Aglycone
AD30999
Formula: C10H13ON3S
Smiles:
O=CN1CC2CCC(C1)N2c1nccs1| HBA: | 4 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.6 |
| AlogP: | 0.95 | Num_rotatable_bonds: | 2 |
| MolWt: | 223.3 | Num_heavy_atoms: | 15 |
| TPSA: | 36.44 | NumAromaticRings: | 1 |
