Glycoside
GD096132
Name:
NoneFormula:
C16H20O6N3ISmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ccc3n[nH]c(I)c3c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1ccc2n[nH]c(I)c2c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 5 |
| MolWt: | 477.26 | Num_heavy_atoms: | 26 |
| TPSA: | 136.93 | NumAromaticRings: | 2 |
Unique Aglycone
AD40887
Formula: C10H10O2N3I
Smiles:
O=C(NCCO)c1ccc2n[nH]c(I)c2c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.2 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 3 |
| MolWt: | 331.11 | Num_heavy_atoms: | 16 |
| TPSA: | 78.01 | NumAromaticRings: | 2 |
