Glycoside
GD082887
Name:
NoneFormula:
C15H19O8N3SSmiles:
Cc1nnc(-c2cccc(S(=O)(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)c2)o1Aglycone:
Cc1nnc(-c2cccc(S(N)(=O)=O)c2)o1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -2.03 | Num_rotatable_bonds: | 9 |
| MolWt: | 401.4 | Num_heavy_atoms: | 27 |
| TPSA: | 183.08 | NumAromaticRings: | 2 |
Unique Aglycone
AD36960
Formula: C9H9O3N3S
Smiles:
Cc1nnc(-c2cccc(S(N)(=O)=O)c2)o1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | 0.69 | Num_rotatable_bonds: | 2 |
| MolWt: | 239.26 | Num_heavy_atoms: | 16 |
| TPSA: | 99.08 | NumAromaticRings: | 2 |
