Glycoside
GD142459
Name:
NoneFormula:
C36H65O14NSmiles:
CCC1OC(=O)C(C)C(OC2OC(O)CC(C)(OC)C2O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(=O)C(C)C(O)C1(C)OAglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(=O)C(C)C(O)C1(C)OSugarmoiety:
COC1(C)CC(O)OC(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.94 |
| AlogP: | 0.72 | Num_rotatable_bonds: | 7 |
| MolWt: | 735.91 | Num_heavy_atoms: | 51 |
| TPSA: | 214.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD00112
Formula: C29H53O10N
Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(=O)C(C)C(O)C1(C)O| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.93 |
| AlogP: | 0.86 | Num_rotatable_bonds: | 4 |
| MolWt: | 575.74 | Num_heavy_atoms: | 40 |
| TPSA: | 166.22 | NumAromaticRings: | 0 |
