Glycoside
GD075824
Name:
NoneFormula:
C13H28O8N3SSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)CN(CC[NH3+])S(C)(=O)=O)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CS(=O)(=O)N(CC[NH3+])CC(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.92 |
| AlogP: | -4.55 | Num_rotatable_bonds: | 9 |
| MolWt: | 386.45 | Num_heavy_atoms: | 25 |
| TPSA: | 173.27 | NumAromaticRings: | 0 |
Unique Aglycone
AD35118
Formula: C7H18O4N3S
Smiles:
CS(=O)(=O)N(CC[NH3+])CC(=O)NCCO| HBA: | 7 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.86 |
| AlogP: | -3.4 | Num_rotatable_bonds: | 7 |
| MolWt: | 240.3 | Num_heavy_atoms: | 15 |
| TPSA: | 114.35 | NumAromaticRings: | 0 |
