Glycoside
...
GD109004

Name:
None

Formula:
C29H31O12N

Smiles:
CC(=O)O[C@H]1[C@H](OC(C)=O)CO[C@@H](OC[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)[C@@H]1OC(C)=O

Aglycone:
O=C(NC(CO)C(=O)O)OCC1c2ccccc2-c2ccccc21

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

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 2 FractionCSP3: 0.41
AlogP: 2.15 Num_rotatable_bonds: 10
MolWt: 585.56 Num_heavy_atoms: 42
TPSA: 172.99 NumAromaticRings: 2

Unique Aglycone
AD44351
Formula: C18H17O5N

Smiles:
O=C(NC(CO)C(=O)O)OCC1c2ccccc2-c2ccccc21
HBA: 6 RingCount: 3
HBD: 3 FractionCSP3: 0.22
AlogP: 1.97 Num_rotatable_bonds: 5
MolWt: 327.34 Num_heavy_atoms: 24
TPSA: 95.86 NumAromaticRings: 2

Sugarmoiety
SD00194

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