Glycoside
...
GD002815

Name:
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-{[3,4,5-trihydroxy-6-({[3-(4-hydroxyphenyl)prop-2-en-1-yl]oxy}methyl)oxan-2-yl]oxy}-4H-chromen-4-one

Formula:
C30H28O12

Smiles:
O=c1c(O[C@@H]2O[C@H](COCC=Cc3ccc(O)cc3)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12

Aglycone:
COCC=Cc1ccc(O)cc1.O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12

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

Other Identifiers

Properties
HBA: 12 RingCount: 5
HBD: 7 FractionCSP3: 0.23
AlogP: 2.2 Num_rotatable_bonds: 8
MolWt: 580.54 Num_heavy_atoms: 42
TPSA: 199.51 NumAromaticRings: 4

Unique Aglycone
AD00022
Formula: C15H10O6

Smiles:
O=c1c(O)c(-c2ccc(O)cc2)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
AD02642
Formula: C10H12O2

Smiles:
COCC=Cc1ccc(O)cc1
HBA: 2 RingCount: 1
HBD: 1 FractionCSP3: 0.2
AlogP: 2.05 Num_rotatable_bonds: 3
MolWt: 164.2 Num_heavy_atoms: 12
TPSA: 29.46 NumAromaticRings: 1

Sugarmoiety
SD00017

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