Glycoside
GD076279
Name:
NoneFormula:
C16H26O7N2SSmiles:
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCS)[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@H]1OAglycone:
O=CNC1CC2CCC(C1)N2C(=O)CCSSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.88 |
| AlogP: | -2.26 | Num_rotatable_bonds: | 4 |
| MolWt: | 390.46 | Num_heavy_atoms: | 26 |
| TPSA: | 139.56 | NumAromaticRings: | 0 |
Unique Aglycone
AD35206
Formula: C11H18O2N2S
Smiles:
O=CNC1CC2CCC(C1)N2C(=O)CCS| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.82 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 4 |
| MolWt: | 242.34 | Num_heavy_atoms: | 16 |
| TPSA: | 49.41 | NumAromaticRings: | 0 |
