Glycoside
GD093812
Name:
NoneFormula:
C19H33O8N3SSmiles:
CC(C)(C)OC(=O)N1C[C@H](N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)C[C@H]1C(=O)N1CCSC1Aglycone:
CC(C)(C)OC(=O)N1CC(N)CC1C(=O)N1CCSC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.89 |
| AlogP: | -1.71 | Num_rotatable_bonds: | 4 |
| MolWt: | 463.55 | Num_heavy_atoms: | 31 |
| TPSA: | 152.03 | NumAromaticRings: | 0 |
Unique Aglycone
AD40450
Formula: C13H23O3N3S
Smiles:
CC(C)(C)OC(=O)N1CC(N)CC1C(=O)N1CCSC1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.85 |
| AlogP: | 0.86 | Num_rotatable_bonds: | 1 |
| MolWt: | 301.41 | Num_heavy_atoms: | 20 |
| TPSA: | 75.87 | NumAromaticRings: | 0 |
