Glycoside
...
GD120067

Name:
1-(8-{[6-(4-amino-1-hydroxybutyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-1-hydroxy-6-methoxy-3-methylnaphthalen-2-yl)butan-1-one

Formula:
C25H35O9N

Smiles:
CCCC(=O)c1c(C)cc2cc(OC)cc(OC3OC(C(O)CCCN)C(O)C(O)C3O)c2c1O

Aglycone:
CCCC(=O)c1c(C)cc2cc(OC)cc(O)c2c1O.NCCCCO

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 10 RingCount: 3
HBD: 7 FractionCSP3: 0.56
AlogP: 1.13 Num_rotatable_bonds: 10
MolWt: 493.55 Num_heavy_atoms: 35
TPSA: 171.93 NumAromaticRings: 2

Unique Aglycone
AD19589
Formula: C4H11ON

Smiles:
NCCCCO
HBA: 2 RingCount: 0
HBD: 3 FractionCSP3: 1.0
AlogP: -0.28 Num_rotatable_bonds: 3
MolWt: 89.14 Num_heavy_atoms: 6
TPSA: 46.25 NumAromaticRings: 0
AD45993
Formula: C16H18O4

Smiles:
CCCC(=O)c1c(C)cc2cc(OC)cc(O)c2c1O
HBA: 4 RingCount: 2
HBD: 2 FractionCSP3: 0.31
AlogP: 3.55 Num_rotatable_bonds: 4
MolWt: 274.32 Num_heavy_atoms: 20
TPSA: 66.76 NumAromaticRings: 2

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O