Glycoside
...
GD136773

Name:
2-(methylazaniumyl)-3-oxo-3-[(3,4,5-trihydroxy-6-{[3-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}oxan-2-yl)methoxy]propanoate

Formula:
C25H25O12N

Smiles:
CNC(C(=O)O)C(=O)OCC1OC(Oc2ccc3c(=O)c(-c4ccc(O)cc4)coc3c2)C(O)C(O)C1O

Aglycone:
CNC(C(=O)O)C(=O)OC.O=c1c(-c2ccc(O)cc2)coc2cc(O)ccc12

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 6 FractionCSP3: 0.32
AlogP: -0.43 Num_rotatable_bonds: 8
MolWt: 531.47 Num_heavy_atoms: 38
TPSA: 205.22 NumAromaticRings: 3

Unique Aglycone
AD04556
Formula: C15H10O4

Smiles:
O=c1c(-c2ccc(O)cc2)coc2cc(O)ccc12
HBA: 4 RingCount: 3
HBD: 2 FractionCSP3: 0.0
AlogP: 2.87 Num_rotatable_bonds: 1
MolWt: 254.24 Num_heavy_atoms: 19
TPSA: 70.67 NumAromaticRings: 3
AD45540
Formula: C5H9O4N

Smiles:
CNC(C(=O)O)C(=O)OC
HBA: 5 RingCount: 0
HBD: 2 FractionCSP3: 0.6
AlogP: -1.17 Num_rotatable_bonds: 3
MolWt: 147.13 Num_heavy_atoms: 10
TPSA: 75.63 NumAromaticRings: 0

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O