Glycoside
GD095393
Name:
NoneFormula:
C12H18O6N3SISmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2nc(N)sc2I)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
Nc1nc(C(=O)NCCO)c(I)s1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.67 |
| AlogP: | -1.1 | Num_rotatable_bonds: | 5 |
| MolWt: | 459.26 | Num_heavy_atoms: | 23 |
| TPSA: | 147.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD40716
Formula: C6H8O2N3SI
Smiles:
Nc1nc(C(=O)NCCO)c(I)s1| HBA: | 5 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 0.05 | Num_rotatable_bonds: | 3 |
| MolWt: | 313.12 | Num_heavy_atoms: | 13 |
| TPSA: | 88.24 | NumAromaticRings: | 1 |
