Glycoside
GD099172
Name:
NoneFormula:
C22H22O6N8Smiles:
O=c1[nH]c(NNC(/C=N/Nc2nc(O)c3ccccc3n2)=C(/O)[C@H](O)[C@H](O)CO)nc2ccccc12Aglycone:
O=c1[nH]c(NNCC=NNc2nc(O)c3ccccc3n2)nc2ccccc12Sugarmoiety:
O=C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.14 |
| AlogP: | 0.07 | Num_rotatable_bonds: | 9 |
| MolWt: | 494.47 | Num_heavy_atoms: | 36 |
| TPSA: | 221.13 | NumAromaticRings: | 4 |
Unique Aglycone
AD42207
Formula: C18H16O2N8
Smiles:
O=c1[nH]c(NNCC=NNc2nc(O)c3ccccc3n2)nc2ccccc12| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.06 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 6 |
| MolWt: | 376.38 | Num_heavy_atoms: | 28 |
| TPSA: | 140.21 | NumAromaticRings: | 4 |
