Glycoside
GD088540
Name:
NoneFormula:
C18H28O9N2SSmiles:
Cc1oc(S(=O)(=O)N2CCCC2)cc1C(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
Cc1oc(S(=O)(=O)N2CCCC2)cc1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.72 |
| AlogP: | -1.05 | Num_rotatable_bonds: | 7 |
| MolWt: | 448.49 | Num_heavy_atoms: | 30 |
| TPSA: | 158.77 | NumAromaticRings: | 1 |
Unique Aglycone
AD38735
Formula: C12H18O5N2S
Smiles:
Cc1oc(S(=O)(=O)N2CCCC2)cc1C(=O)NCCO| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.58 |
| AlogP: | 0.09 | Num_rotatable_bonds: | 5 |
| MolWt: | 302.35 | Num_heavy_atoms: | 20 |
| TPSA: | 99.85 | NumAromaticRings: | 1 |
