Glycoside
GD005313
Name:
NoneFormula:
C30H62O6N4Smiles:
CCCCCCCCCCCO[C@@H]1[C@H](N)[C@H](O[C@@H]2[C@H](N)C[C@H](N)[C@H](OCCCCCCC)[C@H]2O)O[C@H](CN)[C@H]1OAglycone:
CCCCCCCCCCCO.CCCCCCCOC1C(N)CC(N)C(O)C1OSugarmoiety:
NCC1OC(O)C(N)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 10 | FractionCSP3: | 1.0 |
| AlogP: | 2.43 | Num_rotatable_bonds: | 21 |
| MolWt: | 574.85 | Num_heavy_atoms: | 40 |
| TPSA: | 181.46 | NumAromaticRings: | 0 |
Unique Aglycone
AD00291
Formula: C13H28O3N2
Smiles:
CCCCCCCOC1C(N)CC(N)C(O)C1O| HBA: | 5 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | 0.12 | Num_rotatable_bonds: | 7 |
| MolWt: | 260.38 | Num_heavy_atoms: | 18 |
| TPSA: | 101.73 | NumAromaticRings: | 0 |
AD04128
Formula: C11H24O
Smiles:
CCCCCCCCCCCO| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 3.51 | Num_rotatable_bonds: | 9 |
| MolWt: | 172.31 | Num_heavy_atoms: | 12 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
