Glycoside
GD017669
Name:
NoneFormula:
C28H26O10N4Smiles:
O=C1c2c(c3c4cccc(O)c4n(C4OC(CO)C(O)C(O)C4O)c3c3[nH]c4c(O)cccc4c23)C(=O)N1NCCOAglycone:
O=C1c2c(c3c4cccc(O)c4[nH]c3c3[nH]c4c(O)cccc4c23)C(=O)N1NCCOSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 7 |
| HBD: | 9 | FractionCSP3: | 0.29 |
| AlogP: | -0.09 | Num_rotatable_bonds: | 5 |
| MolWt: | 578.53 | Num_heavy_atoms: | 42 |
| TPSA: | 220.97 | NumAromaticRings: | 5 |
Unique Aglycone
AD12590
Formula: C22H16O5N4
Smiles:
O=C1c2c(c3c4cccc(O)c4[nH]c3c3[nH]c4c(O)cccc4c23)C(=O)N1NCCO| HBA: | 9 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.09 |
| AlogP: | 2.46 | Num_rotatable_bonds: | 3 |
| MolWt: | 416.39 | Num_heavy_atoms: | 31 |
| TPSA: | 141.68 | NumAromaticRings: | 5 |
