Glycoside
...
GD125330

Name:
4-[(6-{[2,4-dihydroxy-5-methoxy-3-(2-phenylethoxy)benzoyloxy]methyl}-3,4,5-trihydroxyoxan-2-yl)oxy]-2-[(1-hydroxypropan-2-yl)amino]-5-methoxybenzoic acid

Formula:
C33H39O15N

Smiles:
COc1cc(C(=O)O)c(NC(C)CO)cc1OC1OC(COC(=O)c2cc(OC)c(O)c(OCCc3ccccc3)c2O)C(O)C(O)C1O

Aglycone:
COC(=O)c1cc(OC)c(O)c(OCCc2ccccc2)c1O.COc1cc(C(=O)O)c(NC(C)CO)cc1O

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

Other Identifiers

Properties
HBA: 16 RingCount: 4
HBD: 8 FractionCSP3: 0.39
AlogP: 1.27 Num_rotatable_bonds: 15
MolWt: 689.67 Num_heavy_atoms: 49
TPSA: 243.16 NumAromaticRings: 3

Unique Aglycone
AD47588
Formula: C17H18O6

Smiles:
COC(=O)c1cc(OC)c(O)c(OCCc2ccccc2)c1O
HBA: 6 RingCount: 2
HBD: 2 FractionCSP3: 0.24
AlogP: 2.51 Num_rotatable_bonds: 6
MolWt: 318.32 Num_heavy_atoms: 23
TPSA: 85.22 NumAromaticRings: 2
AD50685
Formula: C11H15O5N

Smiles:
COc1cc(C(=O)O)c(NC(C)CO)cc1O
HBA: 6 RingCount: 1
HBD: 4 FractionCSP3: 0.36
AlogP: 0.89 Num_rotatable_bonds: 5
MolWt: 241.24 Num_heavy_atoms: 17
TPSA: 99.02 NumAromaticRings: 1

Sugarmoiety
SD00017

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