Glycoside
GD086382
Name:
NoneFormula:
C11H16O6N3SISmiles:
CSc1nc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(I)c(=O)[nH]1Aglycone:
CSc1nc(N)c(I)c(=O)[nH]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.64 |
| AlogP: | -1.69 | Num_rotatable_bonds: | 4 |
| MolWt: | 445.24 | Num_heavy_atoms: | 22 |
| TPSA: | 147.93 | NumAromaticRings: | 1 |
Unique Aglycone
AD36288
Formula: C5H6ON3SI
Smiles:
CSc1nc(N)c(I)c(=O)[nH]1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.2 |
| AlogP: | 0.68 | Num_rotatable_bonds: | 1 |
| MolWt: | 283.09 | Num_heavy_atoms: | 11 |
| TPSA: | 71.77 | NumAromaticRings: | 1 |
