Glycoside
GD005166
Name:
NoneFormula:
C35H51O10N7Smiles:
CCn1c2ccccc2c2cc(NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C(O)C(O)C(O)C(O)CO)ccc21Aglycone:
CCn1c2ccccc2c2cc(NC(=O)C(CCCCN)NC(=O)C(C)NC(=O)C(C)NC(=O)C(C)N)ccc21Sugarmoiety:
O=C(O)C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 17 | RingCount: | 3 |
| HBD: | 12 | FractionCSP3: | 0.51 |
| AlogP: | -1.68 | Num_rotatable_bonds: | 19 |
| MolWt: | 729.83 | Num_heavy_atoms: | 52 |
| TPSA: | 277.6 | NumAromaticRings: | 3 |
Unique Aglycone
AD04413
Formula: C29H41O4N7
Smiles:
CCn1c2ccccc2c2cc(NC(=O)C(CCCCN)NC(=O)C(C)NC(=O)C(C)NC(=O)C(C)N)ccc21| HBA: | 11 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.45 |
| AlogP: | 1.72 | Num_rotatable_bonds: | 13 |
| MolWt: | 551.69 | Num_heavy_atoms: | 40 |
| TPSA: | 173.37 | NumAromaticRings: | 3 |
