Glycoside
...
GD083886

Name:
None

Formula:
C20H22O7N2

Smiles:
CCN1C(=O)c2cccc3c(N[C@H]4[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]4O)ccc(c23)C1=O

Aglycone:
CCN1C(=O)c2cccc3c(N)ccc(c23)C1=O

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 4
HBD: 5 FractionCSP3: 0.4
AlogP: -0.33 Num_rotatable_bonds: 4
MolWt: 402.4 Num_heavy_atoms: 29
TPSA: 139.56 NumAromaticRings: 2

Unique Aglycone
AD37401
Formula: C14H12O2N2

Smiles:
CCN1C(=O)c2cccc3c(N)ccc(c23)C1=O
HBA: 4 RingCount: 3
HBD: 2 FractionCSP3: 0.14
AlogP: 2.04 Num_rotatable_bonds: 1
MolWt: 240.26 Num_heavy_atoms: 18
TPSA: 63.4 NumAromaticRings: 2

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O