Glycoside
GD082674
Name:
NoneFormula:
C17H31O7N2SSmiles:
CC(C)(C)OC(=O)N1CC2(C[C@H]([NH2+][C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)CS2)C1Aglycone:
CC(C)(C)OC(=O)N1CC2(CC([NH3+])CS2)C1Sugarmoiety:
O=CC([OH2+])C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | -2.31 | Num_rotatable_bonds: | 7 |
| MolWt: | 407.51 | Num_heavy_atoms: | 27 |
| TPSA: | 144.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD37097
Formula: C11H21O2N2S
Smiles:
CC(C)(C)OC(=O)N1CC2(CC([NH3+])CS2)C1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.91 |
| AlogP: | 0.72 | Num_rotatable_bonds: | 0 |
| MolWt: | 245.37 | Num_heavy_atoms: | 16 |
| TPSA: | 57.18 | NumAromaticRings: | 0 |
