Glycoside
GD033426
Name:
CONFORMYCINFormula:
C12H17O5N3Smiles:
OC[C@@H]1OC(n2cnc3c2N=CCC[C@H]3O)[C@H](O)[C@H]1OAglycone:
OC1CCC=NC2=C1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 2 |
| MolWt: | 283.28 | Num_heavy_atoms: | 20 |
| TPSA: | 120.33 | NumAromaticRings: | 1 |
Unique Aglycone
AD21332
Formula: C7H8ON3
Smiles:
OC1CCC=NC2=C1N=C[N]2| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.43 |
| AlogP: | 0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 150.16 | Num_heavy_atoms: | 11 |
| TPSA: | 59.05 | NumAromaticRings: | 0 |
