Glycoside
...
GD017958

Name:
None

Formula:
C38H46O16N2

Smiles:
COc1ccc(O[C@@H]2O[C@H](CO[C@@]3(C(=O)O)C[C@H](O)[C@H](NC(=O)CO)[C@H]([C@H](O)[C@H](O)CNC(=O)C(c4ccccc4)c4ccccc4)O3)[C@H](O)[C@H](O)[C@H]2O)cc1

Aglycone:
COC1(C(=O)O)CC(O)C(NC(=O)CO)C(C(O)C(O)CNC(=O)C(c2ccccc2)c2ccccc2)O1.COc1ccc(O)cc1

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

Other Identifiers

Properties
HBA: 18 RingCount: 5
HBD: 10 FractionCSP3: 0.45
AlogP: -2.02 Num_rotatable_bonds: 16
MolWt: 786.78 Num_heavy_atoms: 56
TPSA: 283.26 NumAromaticRings: 3

Unique Aglycone
AD01111
Formula: C7H8O2

Smiles:
COc1ccc(O)cc1
HBA: 2 RingCount: 1
HBD: 1 FractionCSP3: 0.14
AlogP: 1.4 Num_rotatable_bonds: 1
MolWt: 124.14 Num_heavy_atoms: 9
TPSA: 29.46 NumAromaticRings: 1
AD12752
Formula: C26H32O10N2

Smiles:
COC1(C(=O)O)CC(O)C(NC(=O)CO)C(C(O)C(O)CNC(=O)C(c2ccccc2)c2ccccc2)O1
HBA: 12 RingCount: 3
HBD: 7 FractionCSP3: 0.42
AlogP: -1.29 Num_rotatable_bonds: 11
MolWt: 532.55 Num_heavy_atoms: 38
TPSA: 194.88 NumAromaticRings: 2

Sugarmoiety
SD00017

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