Glycoside
...
GD016411

Name:
None

Formula:
C54H96O7N4Cl2

Smiles:
CCCCCCCCCCCCCCCCOC[C@H](CO[C@@H]1O[C@H](CNCCCCCCCCCCCCNC(=O)CCCc2ccc(N(CCCl)CCCl)cc2)[C@H](O)[C@H](O)[C@H]1N)OC

Aglycone:
CCCCCCCCCCCCCCCCOCC(CO)OC.CNCCCCCCCCCCCCNC(=O)CCCc1ccc(N(CCCl)CCCl)cc1

Sugarmoiety:
NC1C(O)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 2
HBD: 6 FractionCSP3: 0.87
AlogP: 10.2 Num_rotatable_bonds: 45
MolWt: 960.27 Num_heavy_atoms: 65
TPSA: 147.77 NumAromaticRings: 1

Unique Aglycone
AD00892
Formula: C20H42O3

Smiles:
CCCCCCCCCCCCCCCCOCC(CO)OC
HBA: 3 RingCount: 0
HBD: 1 FractionCSP3: 1.0
AlogP: 5.49 Num_rotatable_bonds: 19
MolWt: 330.55 Num_heavy_atoms: 23
TPSA: 38.69 NumAromaticRings: 0
AD11820
Formula: C29H47ON3Cl2

Smiles:
CNCCCCCCCCCCCCNC(=O)CCCc1ccc(N(CCCl)CCCl)cc1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.74
AlogP: 6.53 Num_rotatable_bonds: 22
MolWt: 500.6 Num_heavy_atoms: 33
TPSA: 44.37 NumAromaticRings: 1

Sugarmoiety
SD00266

NC1C(O)OC(O)C(O)C1O