Glycoside
GD015654
Name:
NoneFormula:
C37H53O10N11Smiles:
Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)nn1)C(N)=OAglycone:
Cc1cc(O)cc(C)c1CC(N)C(=O)NC(CCCNC(=N)N)C(=O)NC(Cc1ccccc1)C(=O)NC(CC1=C[N]N=N1)C(N)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 21 | RingCount: | 4 |
| HBD: | 16 | FractionCSP3: | 0.49 |
| AlogP: | -3.87 | Num_rotatable_bonds: | 19 |
| MolWt: | 811.9 | Num_heavy_atoms: | 58 |
| TPSA: | 359.4 | NumAromaticRings: | 3 |
Unique Aglycone
AD11354
Formula: C31H42O5N11
Smiles:
Cc1cc(O)cc(C)c1CC(N)C(=O)NC(CCCNC(=N)N)C(=O)NC(Cc1ccccc1)C(=O)NC(CC1=C[N]N=N1)C(N)=O| HBA: | 16 | RingCount: | 3 |
| HBD: | 12 | FractionCSP3: | 0.39 |
| AlogP: | -0.46 | Num_rotatable_bonds: | 17 |
| MolWt: | 648.75 | Num_heavy_atoms: | 47 |
| TPSA: | 277.36 | NumAromaticRings: | 2 |
