Glycoside
GD156817
Name:
methylated neonaucleoside cFormula:
C46H58O20N2Smiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC1c2[nH]c3ccccc3c2C(C2CC3C(=COC(OC4OC(CO)C(O)C(O)C4O)C3C=C)C(=O)O2)C(C(=O)OC)N1CAglycone:
C=CC1C(O)OC=C(C(=O)OC)C1CC1c2[nH]c3ccccc3c2C(C2CC3C(=COC(O)C3C=C)C(=O)O2)C(C(=O)OC)N1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 22 | RingCount: | 8 |
| HBD: | 9 | FractionCSP3: | 0.59 |
| AlogP: | -1.39 | Num_rotatable_bonds: | 13 |
| MolWt: | 958.96 | Num_heavy_atoms: | 68 |
| TPSA: | 315.15 | NumAromaticRings: | 2 |
Unique Aglycone
AD62052
Formula: C34H38O10N2
Smiles:
C=CC1C(O)OC=C(C(=O)OC)C1CC1c2[nH]c3ccccc3c2C(C2CC3C(=COC(O)C3C=C)C(=O)O2)C(C(=O)OC)N1C| HBA: | 12 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.44 |
| AlogP: | 2.96 | Num_rotatable_bonds: | 7 |
| MolWt: | 634.68 | Num_heavy_atoms: | 46 |
| TPSA: | 156.85 | NumAromaticRings: | 2 |
