Glycoside
...
GD036187

Name:
None

Formula:
C25H49O7N5

Smiles:
CCCCC1=C(CN)O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@@H]3OC[C@@](C)(O)[C@H](NC)[C@H]3O)[C@@H](NCC)C[C@H]2N)[C@H](N)C1

Aglycone:
CCCCC1=C(CN)OC(OC2C(N)CC(NCC)C(O)C2O)C(N)C1

Sugarmoiety:
CNC1C(O)C(O)OCC1(C)O

Other Identifiers

Properties
HBA: 12 RingCount: 3
HBD: 11 FractionCSP3: 0.92
AlogP: -1.64 Num_rotatable_bonds: 11
MolWt: 531.7 Num_heavy_atoms: 37
TPSA: 199.73 NumAromaticRings: 0

Unique Aglycone
AD22850
Formula: C18H36O4N4

Smiles:
CCCCC1=C(CN)OC(OC2C(N)CC(NCC)C(O)C2O)C(N)C1
HBA: 8 RingCount: 2
HBD: 9 FractionCSP3: 0.89
AlogP: -0.72 Num_rotatable_bonds: 8
MolWt: 372.51 Num_heavy_atoms: 26
TPSA: 149.01 NumAromaticRings: 0

Sugarmoiety
SD00572

CNC1C(O)C(O)OCC1(C)O