Glycoside
GD034842
Name:
NoneFormula:
C28H26O12N4Smiles:
COc1ccc2oc(=O)c(C(C)=NNC(=O)C(O)C(O)C(=O)NN=C(C)c3c(O)c4cc(OC)ccc4oc3=O)c(O)c2c1Aglycone:
COc1ccc2oc(=O)c(C(C)=NN)c(O)c2c1.COc1ccc2oc(=O)c(C(C)=NN)c(O)c2c1Sugarmoiety:
O=C(O)C(O)C(O)C(=O)OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.21 |
| AlogP: | 0.43 | Num_rotatable_bonds: | 9 |
| MolWt: | 610.53 | Num_heavy_atoms: | 44 |
| TPSA: | 242.72 | NumAromaticRings: | 4 |
Unique Aglycone
AD22099
Formula: C12H12O4N2
Smiles:
COc1ccc2oc(=O)c(C(C)=NN)c(O)c2c1| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.17 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 2 |
| MolWt: | 248.24 | Num_heavy_atoms: | 18 |
| TPSA: | 98.05 | NumAromaticRings: | 2 |
