Glycoside
...
GD011191

Name:
None

Formula:
C58H91O13N

Smiles:
CCCCCCCCCCCCCCO[C@H]1[C@@H](OCCCCCCCCCCCCCC)[C@H](OC)[C@@H](COC(=O)CCC(=O)OC[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)O[C@H]1OC

Aglycone:
CCCCCCCCCCCCCCO.CCCCCCCCCCCCCCO.COC(=O)CCC(=O)OCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

Sugarmoiety:
COC1OC(O)C(OC)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 4
HBD: 2 FractionCSP3: 0.72
AlogP: 12.4 Num_rotatable_bonds: 41
MolWt: 1010.36 Num_heavy_atoms: 72
TPSA: 174.38 NumAromaticRings: 2

Unique Aglycone
AD00065
Formula: C14H30O

Smiles:
CCCCCCCCCCCCCCO
HBA: 1 RingCount: 0
HBD: 1 FractionCSP3: 1.0
AlogP: 4.68 Num_rotatable_bonds: 12
MolWt: 214.39 Num_heavy_atoms: 15
TPSA: 20.23 NumAromaticRings: 0
AD08578
Formula: C23H23O8N

Smiles:
COC(=O)CCC(=O)OCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
HBA: 9 RingCount: 3
HBD: 2 FractionCSP3: 0.3
AlogP: 2.47 Num_rotatable_bonds: 9
MolWt: 441.44 Num_heavy_atoms: 32
TPSA: 128.23 NumAromaticRings: 2

Sugarmoiety
SD01618

COC1OC(O)C(OC)C(O)C1O