Glycoside
...
GD153959

Name:
4-[(6-{[2,4-dihydroxy-5-methoxy-3-(2-phenylethoxy)benzoyloxy](hydroxy)methyl}-3,4,5-trihydroxyoxan-2-yl)oxy]-2-(ethylamino)-5-[(N'-methylcarbamimidamido)methoxy]benzoic acid

Formula:
C34H42O15N4

Smiles:
CCNc1cc(OC2OC(C(O)OC(=O)c3cc(OC)c(O)c(OCCc4ccccc4)c3O)C(O)C(O)C2O)c(OCNC(=N)NC)cc1C(=O)O

Aglycone:
CCNc1cc(O)c(OCNC(=N)NC)cc1C(=O)O.COc1cc(C(=O)OCO)c(O)c(OCCc2ccccc2)c1O

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

Other Identifiers

Properties
HBA: 19 RingCount: 4
HBD: 11 FractionCSP3: 0.38
AlogP: 0.3 Num_rotatable_bonds: 16
MolWt: 746.72 Num_heavy_atoms: 53
TPSA: 291.07 NumAromaticRings: 3

Unique Aglycone
AD46138
Formula: C17H18O7

Smiles:
COc1cc(C(=O)OCO)c(O)c(OCCc2ccccc2)c1O
HBA: 7 RingCount: 2
HBD: 3 FractionCSP3: 0.24
AlogP: 1.83 Num_rotatable_bonds: 7
MolWt: 334.32 Num_heavy_atoms: 24
TPSA: 105.45 NumAromaticRings: 2
AD50635
Formula: C12H18O4N4

Smiles:
CCNc1cc(O)c(OCNC(=N)NC)cc1C(=O)O
HBA: 8 RingCount: 1
HBD: 6 FractionCSP3: 0.33
AlogP: 0.6 Num_rotatable_bonds: 6
MolWt: 282.3 Num_heavy_atoms: 20
TPSA: 126.7 NumAromaticRings: 1

Sugarmoiety
SD00017

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