Glycoside
GD033812
Name:
NoneFormula:
C30H54O12N6Smiles:
CC(C)C[C@H](NC(=O)[C@H](NC(=O)[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)C(C)C)C(=O)NCC(=O)N[C@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)OAglycone:
CC(C)CC(NC(=O)C(N)C(C)C)C(=O)NCC(=O)NC(CCCCN)C(=O)N1CCCC1C(=O)OSugarmoiety:
O=C(O)C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 18 | RingCount: | 1 |
| HBD: | 12 | FractionCSP3: | 0.8 |
| AlogP: | -4.1 | Num_rotatable_bonds: | 21 |
| MolWt: | 690.79 | Num_heavy_atoms: | 48 |
| TPSA: | 301.18 | NumAromaticRings: | 0 |
Unique Aglycone
AD21557
Formula: C24H44O6N6
Smiles:
CC(C)CC(NC(=O)C(N)C(C)C)C(=O)NCC(=O)NC(CCCCN)C(=O)N1CCCC1C(=O)O| HBA: | 12 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.79 |
| AlogP: | -0.69 | Num_rotatable_bonds: | 15 |
| MolWt: | 512.65 | Num_heavy_atoms: | 36 |
| TPSA: | 196.95 | NumAromaticRings: | 0 |
