Glycoside

GD005116
Name:
NoneFormula:
C53H96O18N2Smiles:
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(OC(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:
CC(=O)OC1C(O)C(C)OC(OC2C(O)C(C)OC(O)C2O)C1OOther Identifiers
Properties
HBA: | 20 | RingCount: | 2 |
HBD: | 8 | FractionCSP3: | 0.91 |
AlogP: | 4.7 | Num_rotatable_bonds: | 38 |
MolWt: | 1049.35 | Num_heavy_atoms: | 73 |
TPSA: | 295.4 | 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)CHBA: | 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 |