Glycoside
GD061402
Name:
NoneFormula:
C14H28O5N2SSmiles:
CC[C@@H](C)CNC(=S)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
CCC(C)CNC(=S)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.93 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 7 |
| MolWt: | 336.45 | Num_heavy_atoms: | 22 |
| TPSA: | 103.21 | NumAromaticRings: | 0 |
Unique Aglycone
AD30124
Formula: C8H18ON2S
Smiles:
CCC(C)CNC(=S)NCCO| HBA: | 3 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.88 |
| AlogP: | 0.49 | Num_rotatable_bonds: | 5 |
| MolWt: | 190.31 | Num_heavy_atoms: | 12 |
| TPSA: | 44.29 | NumAromaticRings: | 0 |
