Glycoside
...
GD097385

Name:
None

Formula:
C22H29O8N3

Smiles:
CCOC(=O)c1nn(-c2ccccc2C(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)cc1C

Aglycone:
CCOC(=O)c1nn(-c2ccccc2C(=O)NCCO)cc1C

Sugarmoiety:
CC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 4 FractionCSP3: 0.5
AlogP: -0.07 Num_rotatable_bonds: 8
MolWt: 463.49 Num_heavy_atoms: 33
TPSA: 152.37 NumAromaticRings: 2

Unique Aglycone
AD41408
Formula: C16H19O4N3

Smiles:
CCOC(=O)c1nn(-c2ccccc2C(=O)NCCO)cc1C
HBA: 7 RingCount: 2
HBD: 2 FractionCSP3: 0.31
AlogP: 1.08 Num_rotatable_bonds: 6
MolWt: 317.35 Num_heavy_atoms: 23
TPSA: 93.45 NumAromaticRings: 2

Sugarmoiety
SD00076

CC1OC(O)C(O)C(O)C1O