Glycoside
GD000720
Name:
NoneFormula:
C25H50O11N6Smiles:
CCCO[C@H]1[C@H](O[C@@H]2O[C@H](C)[C@H](N)[C@H](O)[C@H]2O)[C@@H](O[C@@H]2O[C@H](CN)[C@H](O)[C@H](O)[C@H]2N)[C@@H](N)C[C@H]1NC(=O)[C@H](O)CCNAglycone:
CCCOC1C(NC(=O)C(O)CCN)CC(N)C(O)C1OSugarmoiety:
CC1OC(O)C(O)C(O)C1N.NCC1OC(O)C(N)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 3 |
| HBD: | 16 | FractionCSP3: | 0.96 |
| AlogP: | -6.0 | Num_rotatable_bonds: | 12 |
| MolWt: | 610.71 | Num_heavy_atoms: | 42 |
| TPSA: | 306.5 | NumAromaticRings: | 0 |
Unique Aglycone
AD00769
Formula: C13H27O5N3
Smiles:
CCCOC1C(NC(=O)C(O)CCN)CC(N)C(O)C1O| HBA: | 8 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.92 |
| AlogP: | -2.57 | Num_rotatable_bonds: | 7 |
| MolWt: | 305.37 | Num_heavy_atoms: | 21 |
| TPSA: | 151.06 | NumAromaticRings: | 0 |
