Glycoside
...
GD156370

Name:
None

Formula:
C38H41O20N3

Smiles:
CNC1=CC(C2=CNC(N)C=C2)c2c(cc3oc(-c4cc(O)c(O)c(CCO)c4)cc(=O)c3c2O)OC12OC(C(=O)OC1OC(C(=O)O)C(O)(O)C(O)C1O)C(O)C(O)C2O

Aglycone:
CNC1=CC(C2=CNC(N)C=C2)c2c(cc3oc(-c4cc(O)c(O)c(CCO)c4)cc(=O)c3c2O)OC12OC(C(=O)O)C(O)C(O)C2O

Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1(O)O

Other Identifiers

Properties
HBA: 23 RingCount: 7
HBD: 16 FractionCSP3: 0.39
AlogP: -4.05 Num_rotatable_bonds: 8
MolWt: 859.75 Num_heavy_atoms: 61
TPSA: 394.11 NumAromaticRings: 3

Unique Aglycone
AD53360
Formula: C32H33O13N3

Smiles:
CNC1=CC(C2=CNC(N)C=C2)c2c(cc3oc(-c4cc(O)c(O)c(CCO)c4)cc(=O)c3c2O)OC12OC(C(=O)O)C(O)C(O)C2O
HBA: 16 RingCount: 6
HBD: 12 FractionCSP3: 0.31
AlogP: -0.72 Num_rotatable_bonds: 6
MolWt: 667.62 Num_heavy_atoms: 48
TPSA: 277.66 NumAromaticRings: 3

Sugarmoiety
SD04330

O=C(O)C1OC(O)C(O)C(O)C1(O)O