Glycoside
GD018272
Name:
NoneFormula:
C34H72O13N10Smiles:
NC[C@@H]1O[C@H](O[C@@H]2[C@H](N)C[C@H](N)[C@H](O)[C@H]2OC[C@H](O)CNCCCCNC[C@H](O)CO[C@H]2[C@H](O[C@@H]3O[C@H](CN)[C@H](O)[C@H](O)[C@H]3N)[C@@H](N)C[C@@H](N)[C@H]2O)[C@H](N)C[C@H]1OAglycone:
NCC1OC(OC2C(N)CC(N)C(O)C2OCC(O)CNCCCCNCC(O)COC2C(O)C(N)CC(N)C2O)C(N)CC1OSugarmoiety:
NCC1OC(O)C(N)C(O)C1OOther Identifiers
Properties
| HBA: | 23 | RingCount: | 4 |
| HBD: | 25 | FractionCSP3: | 1.0 |
| AlogP: | -9.46 | Num_rotatable_bonds: | 21 |
| MolWt: | 829.01 | Num_heavy_atoms: | 57 |
| TPSA: | 429.21 | NumAromaticRings: | 0 |
Unique Aglycone
AD12922
Formula: C28H60O10N8
Smiles:
NCC1OC(OC2C(N)CC(N)C(O)C2OCC(O)CNCCCCNCC(O)COC2C(O)C(N)CC(N)C2O)C(N)CC1O| HBA: | 18 | RingCount: | 3 |
| HBD: | 20 | FractionCSP3: | 1.0 |
| AlogP: | -7.22 | Num_rotatable_bonds: | 18 |
| MolWt: | 668.83 | Num_heavy_atoms: | 46 |
| TPSA: | 338.48 | NumAromaticRings: | 0 |
