Glycoside
GD003744
Name:
NoneFormula:
C26H53O10N5Smiles:
CCCCCCCCNC[C@@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@@H]3O[C@H](CN)[C@H](O)[C@H](O)[C@H]3O)[C@@H](N)C[C@H]2N)[C@H](O)[C@H](N)[C@H]1OAglycone:
CCCCCCCCNC.NC1CC(N)C(O)C(O)C1OSugarmoiety:
NC1C(O)C(O)OC(O)C1O.NCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 15 | FractionCSP3: | 1.0 |
| AlogP: | -4.33 | Num_rotatable_bonds: | 14 |
| MolWt: | 595.74 | Num_heavy_atoms: | 41 |
| TPSA: | 274.41 | NumAromaticRings: | 0 |
Unique Aglycone
AD00009
Formula: C6H14O3N2
Smiles:
NC1CC(N)C(O)C(O)C1O| HBA: | 5 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | -2.87 | Num_rotatable_bonds: | 0 |
| MolWt: | 162.19 | Num_heavy_atoms: | 11 |
| TPSA: | 112.73 | NumAromaticRings: | 0 |
AD03356
Formula: C9H21N
Smiles:
CCCCCCCCNC| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 2.57 | Num_rotatable_bonds: | 7 |
| MolWt: | 143.27 | Num_heavy_atoms: | 10 |
| TPSA: | 12.03 | NumAromaticRings: | 0 |
