Glycoside
GD103215
Name:
NoneFormula:
C20H21O7N3S2Smiles:
Cc1cn2c(=O)c(C(=O)Nc3ccc(S[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@@H]4O)cc3)cnc2s1Aglycone:
Cc1cn2c(=O)c(C(=O)Nc3ccc(S)cc3)cnc2s1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.21 | Num_rotatable_bonds: | 5 |
| MolWt: | 479.54 | Num_heavy_atoms: | 32 |
| TPSA: | 153.62 | NumAromaticRings: | 3 |
Unique Aglycone
AD43673
Formula: C14H11O2N3S2
Smiles:
Cc1cn2c(=O)c(C(=O)Nc3ccc(S)cc3)cnc2s1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.07 |
| AlogP: | 2.61 | Num_rotatable_bonds: | 2 |
| MolWt: | 317.4 | Num_heavy_atoms: | 21 |
| TPSA: | 63.47 | NumAromaticRings: | 3 |
