Glycoside
GD066969
Name:
NoneFormula:
C13H27O7N2SSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@@H]([NH3+])CC[S@@](C)=O)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CS(=O)CCC([NH3+])C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.92 |
| AlogP: | -3.67 | Num_rotatable_bonds: | 8 |
| MolWt: | 355.43 | Num_heavy_atoms: | 23 |
| TPSA: | 152.96 | NumAromaticRings: | 0 |
Unique Aglycone
AD32014
Formula: C7H17O3N2S
Smiles:
CS(=O)CCC([NH3+])C(=O)NCCO| HBA: | 5 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.86 |
| AlogP: | -2.53 | Num_rotatable_bonds: | 6 |
| MolWt: | 209.29 | Num_heavy_atoms: | 13 |
| TPSA: | 94.04 | NumAromaticRings: | 0 |
