Glycoside
...
GD000251

Name:
None

Formula:
C39H56O6N4

Smiles:
CCCCCCCO[C@H]1[C@H](O)[C@@H](O[C@@H]2O[C@H](CN)[C@H](O)[C@H](OCCCCc3cc4ccc5cccc6ccc(c3)c4c56)[C@H]2N)[C@@H](N)C[C@H]1N

Aglycone:
CCCCCCCOC1C(N)CC(N)C(O)C1O.OCCCCc1cc2ccc3cccc4ccc(c1)c2c34

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

Other Identifiers

Properties
HBA: 10 RingCount: 6
HBD: 10 FractionCSP3: 0.59
AlogP: 3.82 Num_rotatable_bonds: 16
MolWt: 676.9 Num_heavy_atoms: 49
TPSA: 181.46 NumAromaticRings: 4

Unique Aglycone
AD00291
Formula: C13H28O3N2

Smiles:
CCCCCCCOC1C(N)CC(N)C(O)C1O
HBA: 5 RingCount: 1
HBD: 6 FractionCSP3: 1.0
AlogP: 0.12 Num_rotatable_bonds: 7
MolWt: 260.38 Num_heavy_atoms: 18
TPSA: 101.73 NumAromaticRings: 0
AD00292
Formula: C20H18O

Smiles:
OCCCCc1cc2ccc3cccc4ccc(c1)c2c34
HBA: 1 RingCount: 4
HBD: 1 FractionCSP3: 0.2
AlogP: 4.9 Num_rotatable_bonds: 4
MolWt: 274.36 Num_heavy_atoms: 21
TPSA: 20.23 NumAromaticRings: 4

Sugarmoiety
SD00112

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