Glycoside
...
GD022522

Name:
None

Formula:
C36H40O8N2

Smiles:
NC(=O)c1ccc(COC(COCc2ccccc2)C(O)C(O)C(COCc2ccccc2)OCc2ccc(C(N)=O)cc2)cc1

Aglycone:
Cc1ccc(C(N)=O)cc1.Cc1ccc(C(N)=O)cc1.Cc1ccccc1.Cc1ccccc1

Sugarmoiety:
OOCC(OO)C(O)C(O)C(COO)OO

Other Identifiers

Properties
HBA: 10 RingCount: 4
HBD: 6 FractionCSP3: 0.28
AlogP: 3.51 Num_rotatable_bonds: 19
MolWt: 628.72 Num_heavy_atoms: 46
TPSA: 163.56 NumAromaticRings: 4

Unique Aglycone
AD00274
Formula: C7H8

Smiles:
Cc1ccccc1
HBA: 0 RingCount: 1
HBD: 0 FractionCSP3: 0.14
AlogP: 2.0 Num_rotatable_bonds: 0
MolWt: 92.14 Num_heavy_atoms: 7
TPSA: 0.0 NumAromaticRings: 1
AD05357
Formula: C8H9ON

Smiles:
Cc1ccc(C(N)=O)cc1
HBA: 2 RingCount: 1
HBD: 2 FractionCSP3: 0.12
AlogP: 1.09 Num_rotatable_bonds: 1
MolWt: 135.17 Num_heavy_atoms: 10
TPSA: 43.09 NumAromaticRings: 1

Sugarmoiety
SD00358

OOCC(OO)C(O)C(O)C(COO)OO