Glycoside
GD003369
Name:
NoneFormula:
C29H45O9N7Smiles:
CC(C)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(=O)n1)C(C)CAglycone:
CC(C)C(N)C(=O)N1CCCC1C(=O)NC(C(=O)N1CCCC1C(=O)Nc1cc[nH]c(=O)n1)C(C)CSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.72 |
| AlogP: | -2.1 | Num_rotatable_bonds: | 10 |
| MolWt: | 635.72 | Num_heavy_atoms: | 45 |
| TPSA: | 229.65 | NumAromaticRings: | 1 |
Unique Aglycone
AD03063
Formula: C24H37O5N7
Smiles:
CC(C)C(N)C(=O)N1CCCC1C(=O)NC(C(=O)N1CCCC1C(=O)Nc1cc[nH]c(=O)n1)C(C)C| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -0.19 | Num_rotatable_bonds: | 8 |
| MolWt: | 503.6 | Num_heavy_atoms: | 36 |
| TPSA: | 170.59 | NumAromaticRings: | 1 |
