Glycoside
...
GD011440

Name:
None

Formula:
C40H72O28N2

Smiles:
COC(=O)CCCCC(=O)NCC(=O)NC(COCOCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)(COCOCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)COCOCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
COC(=O)CCCCC(=O)NCC(=O)NC(COCOCCO)(COCOCCO)COCOCCO

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

Other Identifiers

Properties
HBA: 30 RingCount: 3
HBD: 14 FractionCSP3: 0.93
AlogP: -8.89 Num_rotatable_bonds: 35
MolWt: 1029.0 Num_heavy_atoms: 70
TPSA: 438.02 NumAromaticRings: 0

Unique Aglycone
AD08750
Formula: C22H42O13N2

Smiles:
COC(=O)CCCCC(=O)NCC(=O)NC(COCOCCO)(COCOCCO)COCOCCO
HBA: 15 RingCount: 0
HBD: 5 FractionCSP3: 0.86
AlogP: -2.36 Num_rotatable_bonds: 26
MolWt: 542.58 Num_heavy_atoms: 37
TPSA: 200.57 NumAromaticRings: 0

Sugarmoiety
SD00130

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