Glycoside
GD016481
Name:
NoneFormula:
C40H61O10N7Smiles:
CCn1c2ccccc2c2cc(NC(=O)[C@H](CCCCN)NC(=O)CN(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](NC(=O)C(O)C(O)C(O)C(O)CO)C(C)C)ccc21Aglycone:
CCn1c2ccccc2c2cc(NC(=O)C(CCCCN)NC(=O)CN(C)C(=O)C(CC(C)C)NC(=O)C(N)C(C)C)ccc21Sugarmoiety:
O=C(O)C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 17 | RingCount: | 3 |
| HBD: | 11 | FractionCSP3: | 0.57 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 22 |
| MolWt: | 799.97 | Num_heavy_atoms: | 57 |
| TPSA: | 268.81 | NumAromaticRings: | 3 |
Unique Aglycone
AD11853
Formula: C34H51O4N7
Smiles:
CCn1c2ccccc2c2cc(NC(=O)C(CCCCN)NC(=O)CN(C)C(=O)C(CC(C)C)NC(=O)C(N)C(C)C)ccc21| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.53 |
| AlogP: | 3.34 | Num_rotatable_bonds: | 16 |
| MolWt: | 621.83 | Num_heavy_atoms: | 45 |
| TPSA: | 164.58 | NumAromaticRings: | 3 |
