Glycoside
GD019624
Name:
NoneFormula:
C51H94O17N2Smiles:
CCCCCCCC(CC(=O)NC(CO)C(=O)NC(CO)CC(C)C)OC(=O)CC(CCCCCCC)OC(=O)CC(CCCCCCC)OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OAglycone:
CCCCCCCC(O)CC(=O)OC(CCCCCCC)CC(=O)OC(CCCCCCC)CC(=O)NC(CO)C(=O)NC(CO)CC(C)CSugarmoiety:
CC1OC(OC2C(O)C(C)OC(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 2 |
| HBD: | 9 | FractionCSP3: | 0.92 |
| AlogP: | 4.13 | Num_rotatable_bonds: | 37 |
| MolWt: | 1007.31 | Num_heavy_atoms: | 70 |
| TPSA: | 289.33 | NumAromaticRings: | 0 |
Unique Aglycone
AD02515
Formula: C39H74O9N2
Smiles:
CCCCCCCC(O)CC(=O)OC(CCCCCCC)CC(=O)OC(CCCCCCC)CC(=O)NC(CO)C(=O)NC(CO)CC(C)C| HBA: | 11 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.9 |
| AlogP: | 6.42 | Num_rotatable_bonds: | 33 |
| MolWt: | 715.03 | Num_heavy_atoms: | 50 |
| TPSA: | 171.49 | NumAromaticRings: | 0 |
