Glycoside
...
GD145805

Name:
4-(acetyloxy)-2-[5-(5,7-dihydroxy-4-oxo-4H-chromen-2-yl)-2-hydroxyphenoxy]-5-hydroxy-6-methyloxan-3-yl 3-(4-hydroxyphenyl)prop-2-enoate

Formula:
C32H28O13

Smiles:
CC(=O)OC1C(O)C(C)OC(Oc2cc(-c3cc(=O)c4c(O)cc(O)cc4o3)ccc2O)C1OC(=O)C=Cc1ccc(O)cc1

Aglycone:
O=C(O)C=Cc1ccc(O)cc1.O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12

Sugarmoiety:
CC(=O)OC1C(O)C(C)OC(O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 5
HBD: 5 FractionCSP3: 0.22
AlogP: 3.32 Num_rotatable_bonds: 7
MolWt: 620.56 Num_heavy_atoms: 45
TPSA: 202.42 NumAromaticRings: 4

Unique Aglycone
AD00021
Formula: C9H8O3

Smiles:
O=C(O)C=Cc1ccc(O)cc1
HBA: 3 RingCount: 1
HBD: 2 FractionCSP3: 0.0
AlogP: 1.49 Num_rotatable_bonds: 2
MolWt: 164.16 Num_heavy_atoms: 12
TPSA: 57.53 NumAromaticRings: 1
AD00567
Formula: C15H10O6

Smiles:
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
HBA: 6 RingCount: 3
HBD: 4 FractionCSP3: 0.0
AlogP: 2.28 Num_rotatable_bonds: 1
MolWt: 286.24 Num_heavy_atoms: 21
TPSA: 111.13 NumAromaticRings: 3

Sugarmoiety
SD01208

CC(=O)OC1C(O)C(C)OC(O)C1O