Glycoside
...
GD110965

Name:
None

Formula:
C28H27O11N

Smiles:
COc1cccc(C(=O)O[C@@H](C(=O)O)[C@@H](OC(=O)c2cccc(OC)c2)C(=O)Nc2cc(OC)ccc2OC)c1

Aglycone:
COc1ccc(OC)c(N)c1.COc1cccc(C=O)c1.COc1cccc(C=O)c1

Sugarmoiety:
O=C(O)C(OO)C(OO)C(=O)O

Other Identifiers

Properties
HBA: 12 RingCount: 3
HBD: 2 FractionCSP3: 0.21
AlogP: 3.2 Num_rotatable_bonds: 12
MolWt: 553.52 Num_heavy_atoms: 40
TPSA: 155.92 NumAromaticRings: 3

Unique Aglycone
AD44013
Formula: C8H8O2

Smiles:
COc1cccc(C=O)c1
HBA: 2 RingCount: 1
HBD: 0 FractionCSP3: 0.12
AlogP: 1.51 Num_rotatable_bonds: 2
MolWt: 136.15 Num_heavy_atoms: 10
TPSA: 26.3 NumAromaticRings: 1
AD44038
Formula: C8H11O2N

Smiles:
COc1ccc(OC)c(N)c1
HBA: 3 RingCount: 1
HBD: 2 FractionCSP3: 0.25
AlogP: 1.29 Num_rotatable_bonds: 2
MolWt: 153.18 Num_heavy_atoms: 11
TPSA: 44.48 NumAromaticRings: 1

Sugarmoiety
SD00296

O=C(O)C(OO)C(OO)C(=O)O