Glycoside
GD027493
Name:
NoneFormula:
C36H47O11N3Smiles:
CCN(CC)Cc1cc(C(=O)Nc2c(O)c3ccc(O[C@@H]4OC(C)(C)[C@H](OC)[C@H](OC(N)=O)[C@H]4O)c(C)c3oc2=O)cc(CC=C(C)C)c1OAglycone:
CCN(CC)Cc1cc(C(=O)Nc2c(O)c3ccc(O)c(C)c3oc2=O)cc(CC=C(C)C)c1OSugarmoiety:
COC1C(OC(N)=O)C(O)C(O)OC1(C)COther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.47 |
| AlogP: | 4.47 | Num_rotatable_bonds: | 12 |
| MolWt: | 697.78 | Num_heavy_atoms: | 50 |
| TPSA: | 203.25 | NumAromaticRings: | 3 |
Unique Aglycone
AD18068
Formula: C27H32O6N2
Smiles:
CCN(CC)Cc1cc(C(=O)Nc2c(O)c3ccc(O)c(C)c3oc2=O)cc(CC=C(C)C)c1O| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 4.82 | Num_rotatable_bonds: | 8 |
| MolWt: | 480.56 | Num_heavy_atoms: | 35 |
| TPSA: | 123.24 | NumAromaticRings: | 3 |
