Glycoside
GD032275
Name:
NoneFormula:
C54H102O16N2Smiles:
CCCCCCCCCCCCCCCCCCOC(=O)[C@H](COC(=O)CON(C)[C@@H]1O[C@H](CO)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCCCCCOC(=O)C(COC(=O)CONC)NC(=O)CCCCCCCCCCCCCCCCCSugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 18 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.94 |
| AlogP: | 6.57 | Num_rotatable_bonds: | 45 |
| MolWt: | 1035.41 | Num_heavy_atoms: | 72 |
| TPSA: | 263.47 | NumAromaticRings: | 0 |
Unique Aglycone
AD15761
Formula: C42H82O6N2
Smiles:
CCCCCCCCCCCCCCCCCCOC(=O)C(COC(=O)CONC)NC(=O)CCCCCCCCCCCCCCCCC| HBA: | 8 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.93 |
| AlogP: | 11.23 | Num_rotatable_bonds: | 40 |
| MolWt: | 711.13 | Num_heavy_atoms: | 50 |
| TPSA: | 102.96 | NumAromaticRings: | 0 |
