Glycoside
...
GD123603

Name:
None

Formula:
C38H40O14N2

Smiles:
COc1ccc2c(c1OC)OC1c3c(CN4C=C5C=CN=C5C4)cc(OC4OC(COC(=O)CC(=O)O)C(O)C(O)C4O)cc3OC3(CCC(=O)CC3)C21

Aglycone:
COC(=O)CC(=O)O.COc1ccc2c(c1OC)OC1c3c(CN4C=C5C=CN=C5C4)cc(O)cc3OC3(CCC(=O)CC3)C21

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

Other Identifiers

Properties
HBA: 16 RingCount: 8
HBD: 4 FractionCSP3: 0.47
AlogP: 2.07 Num_rotatable_bonds: 10
MolWt: 748.74 Num_heavy_atoms: 54
TPSA: 212.34 NumAromaticRings: 2

Unique Aglycone
AD04733
Formula: C4H6O4

Smiles:
COC(=O)CC(=O)O
HBA: 4 RingCount: 0
HBD: 1 FractionCSP3: 0.5
AlogP: -0.37 Num_rotatable_bonds: 2
MolWt: 118.09 Num_heavy_atoms: 8
TPSA: 63.6 NumAromaticRings: 0
AD49895
Formula: C29H28O6N2

Smiles:
COc1ccc2c(c1OC)OC1c3c(CN4C=C5C=CN=C5C4)cc(O)cc3OC3(CCC(=O)CC3)C21
HBA: 8 RingCount: 7
HBD: 1 FractionCSP3: 0.38
AlogP: 4.57 Num_rotatable_bonds: 4
MolWt: 500.55 Num_heavy_atoms: 37
TPSA: 89.82 NumAromaticRings: 2

Sugarmoiety
SD00017

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