Glycoside
GD026599
Name:
NoneFormula:
C27H25O6N3Smiles:
COC1C(CO)OC(n2c3ccccc3c3c4c(c5c6ccccc6[nH]c5c32)CNC4=O)C(O)C1OAglycone:
O=C1NCc2c1c1c3ccccc3[nH]c1c1[nH]c3ccccc3c21Sugarmoiety:
COC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 7 |
| HBD: | 5 | FractionCSP3: | 0.3 |
| AlogP: | 2.3 | Num_rotatable_bonds: | 3 |
| MolWt: | 487.51 | Num_heavy_atoms: | 36 |
| TPSA: | 128.97 | NumAromaticRings: | 5 |
Unique Aglycone
AD13787
Formula: C20H13ON3
Smiles:
O=C1NCc2c1c1c3ccccc3[nH]c1c1[nH]c3ccccc3c21| HBA: | 4 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.05 |
| AlogP: | 4.2 | Num_rotatable_bonds: | 0 |
| MolWt: | 311.34 | Num_heavy_atoms: | 24 |
| TPSA: | 60.68 | NumAromaticRings: | 5 |
