Glycoside
...
GD028921

Name:
None

Formula:
C28H30O7N2

Smiles:
CC(=O)O[C@H]1[C@H](OC(C)=O)CO[C@H](N2C=Cc3c(c(C)c4c([nH]c5ccccc54)c3C)C2)[C@@H]1OC(C)=O

Aglycone:
Cc1c2c(c(C)c3c1[nH]c1ccccc13)CNC=C2

Sugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 9 RingCount: 5
HBD: 1 FractionCSP3: 0.39
AlogP: 3.88 Num_rotatable_bonds: 4
MolWt: 506.56 Num_heavy_atoms: 37
TPSA: 107.16 NumAromaticRings: 3

Unique Aglycone
AD18856
Formula: C17H16N2

Smiles:
Cc1c2c(c(C)c3c1[nH]c1ccccc13)CNC=C2
HBA: 2 RingCount: 4
HBD: 2 FractionCSP3: 0.18
AlogP: 4.01 Num_rotatable_bonds: 0
MolWt: 248.33 Num_heavy_atoms: 19
TPSA: 27.82 NumAromaticRings: 3

Sugarmoiety
SD00194

CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=O