Glycoside
...
GD006686

Name:
None

Formula:
C31H64O9N4

Smiles:
CCCCCCCCCCCCCCCCOC[C@H](CO[C@@H]1O[C@H](CN)[C@H](O)[C@H](O)[C@H]1N)O[C@@H]1O[C@H](CN)[C@H](O)[C@H](O)[C@H]1N

Aglycone:
CCCCCCCCCCCCCCCCOCC(O)CO

Sugarmoiety:
NCC1OC(O)C(N)C(O)C1O.NCC1OC(O)C(N)C(O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 2
HBD: 12 FractionCSP3: 1.0
AlogP: 0.35 Num_rotatable_bonds: 24
MolWt: 636.87 Num_heavy_atoms: 44
TPSA: 231.15 NumAromaticRings: 0

Unique Aglycone
AD05501
Formula: C19H40O3

Smiles:
CCCCCCCCCCCCCCCCOCC(O)CO
HBA: 3 RingCount: 0
HBD: 2 FractionCSP3: 1.0
AlogP: 4.84 Num_rotatable_bonds: 18
MolWt: 316.53 Num_heavy_atoms: 22
TPSA: 49.69 NumAromaticRings: 0

Sugarmoiety
SD00211

NCC1OC(O)C(N)C(O)C1O.NCC1OC(O)C(N)C(O)C1O