Glycoside
GD023457
Name:
NoneFormula:
C58H70O12N8Cl4Smiles:
CN1Cc2c(Cl)cc(Cl)cc2C(c2cccc(NC(=O)NCCOCCOCCOCCNC(=O)C(O)C(O)C(=O)NCCOCCOCCOCCNC(=O)Nc3cccc(C4CN(C)Cc5c(Cl)cc(Cl)cc54)c3)c2)C1Aglycone:
CN1Cc2c(Cl)cc(Cl)cc2C(c2cccc(NC(=O)NCCOCCOCCOCCN)c2)C1.CN1Cc2c(Cl)cc(Cl)cc2C(c2cccc(NC(=O)NCCOCCOCCOCCN)c2)C1Sugarmoiety:
O=C(O)C(O)C(O)C(=O)OOther Identifiers
Properties
| HBA: | 20 | RingCount: | 6 |
| HBD: | 8 | FractionCSP3: | 0.48 |
| AlogP: | 5.45 | Num_rotatable_bonds: | 31 |
| MolWt: | 1165.01 | Num_heavy_atoms: | 78 |
| TPSA: | 242.78 | NumAromaticRings: | 4 |
Unique Aglycone
AD15771
Formula: C27H34O4N4Cl2
Smiles:
CN1Cc2c(Cl)cc(Cl)cc2C(c2cccc(NC(=O)NCCOCCOCCOCCN)c2)C1| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.48 |
| AlogP: | 3.7 | Num_rotatable_bonds: | 13 |
| MolWt: | 525.48 | Num_heavy_atoms: | 35 |
| TPSA: | 98.08 | NumAromaticRings: | 2 |
