Glycoside
GD034542
Name:
NoneFormula:
C24H50O12N6Smiles:
CC1OC(OC2C(N)CC(N)C(OC3OC(CN)C(O)C(O)C3N)C2O)C(O)C(O)C1OCC(CN)OCC(O)CNAglycone:
NC1CC(N)C(O)C(O)C1O.NCC(O)COC(CN)COSugarmoiety:
CC1OC(O)C(O)C(O)C1O.NCC1OC(O)C(N)C(O)C1OOther Identifiers
Properties
| HBA: | 18 | RingCount: | 3 |
| HBD: | 18 | FractionCSP3: | 1.0 |
| AlogP: | -7.58 | Num_rotatable_bonds: | 13 |
| MolWt: | 614.69 | Num_heavy_atoms: | 42 |
| TPSA: | 332.88 | 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 |
AD21953
Formula: C6H16O3N2
Smiles:
NCC(O)COC(CN)CO| HBA: | 5 | RingCount: | 0 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -2.36 | Num_rotatable_bonds: | 6 |
| MolWt: | 164.2 | Num_heavy_atoms: | 11 |
| TPSA: | 101.73 | NumAromaticRings: | 0 |
