Glycoside
...
GD146635

Name:
None

Formula:
C28H28O11N2

Smiles:
COc1cc(OC2OC(O)(CO)C(O)C(O)C2O)c2c(c1)C(=[O+])c1cc(CCc3ccc(N)nc3)cc(O)c1C2=O

Aglycone:
COc1cc(O)c2c(c1)C(=[OH+])c1cc(CCc3ccc(N)nc3)cc(O)c1C2=O

Sugarmoiety:
OCC1(O)OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 5
HBD: 8 FractionCSP3: 0.32
AlogP: -0.56 Num_rotatable_bonds: 7
MolWt: 568.54 Num_heavy_atoms: 41
TPSA: 224.95 NumAromaticRings: 3

Unique Aglycone
AD57821
Formula: C22H19O5N2

Smiles:
COc1cc(O)c2c(c1)C(=[OH+])c1cc(CCc3ccc(N)nc3)cc(O)c1C2=O
HBA: 7 RingCount: 4
HBD: 5 FractionCSP3: 0.14
AlogP: 2.35 Num_rotatable_bonds: 4
MolWt: 391.4 Num_heavy_atoms: 29
TPSA: 127.07 NumAromaticRings: 3

Sugarmoiety
SD03584

OCC1(O)OC(O)C(O)C(O)C1O