Glycoside
...
GD013784

Name:
None

Formula:
C24H29O14N3

Smiles:
COc1nc2c(c(O)c(C)c(=O)n2OC2OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)c(=O)n1C

Aglycone:
COC(C)=O.COc1nc2c(c(O)c(C)c(=O)n2O)c(=O)n1C

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 17 RingCount: 3
HBD: 1 FractionCSP3: 0.54
AlogP: -1.37 Num_rotatable_bonds: 8
MolWt: 583.5 Num_heavy_atoms: 41
TPSA: 210.01 NumAromaticRings: 2

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD10231
Formula: C10H11O5N3

Smiles:
COc1nc2c(c(O)c(C)c(=O)n2O)c(=O)n1C
HBA: 8 RingCount: 2
HBD: 2 FractionCSP3: 0.3
AlogP: -0.64 Num_rotatable_bonds: 1
MolWt: 253.21 Num_heavy_atoms: 18
TPSA: 106.58 NumAromaticRings: 2

Sugarmoiety
SD00012

CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O