Glycoside
...
GD014155

Name:
None

Formula:
C50H99O7N

Smiles:
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@H](CCCCCCCCCCCCCCCC)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)CCCCCCCCCCCCCCCC

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 8 RingCount: 1
HBD: 5 FractionCSP3: 0.98
AlogP: 12.54 Num_rotatable_bonds: 44
MolWt: 826.34 Num_heavy_atoms: 58
TPSA: 128.48 NumAromaticRings: 0

Unique Aglycone
AD10454
Formula: C44H89O2N

Smiles:
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)CCCCCCCCCCCCCCCC
HBA: 3 RingCount: 0
HBD: 2 FractionCSP3: 0.98
AlogP: 14.72 Num_rotatable_bonds: 41
MolWt: 664.2 Num_heavy_atoms: 47
TPSA: 49.33 NumAromaticRings: 0

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O