Glycoside
...
GD119911

Name:
2-{4-[3-(3,5-dihydroxyphenyl)-4-hydroxy-6-[4-hydroxy-2-(4-hydroxyphenyl)-6-[2-(4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]-2,3-dihydro-1-benzofuran-2-yl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

Formula:
C54H52O19

Smiles:
OCC1OC(Oc2ccc(C=Cc3cc(O)c4c(c3)OC(c3ccc(O)cc3)C4c3cc(O)c4c(c3)OC(c3ccc(OC5OC(CO)C(O)C(O)C5O)cc3)C4c3cc(O)cc(O)c3)cc2)C(O)C(O)C1O

Aglycone:
Oc1ccc(C=Cc2cc(O)c3c(c2)OC(c2ccc(O)cc2)C3c2cc(O)c3c(c2)OC(c2ccc(O)cc2)C3c2cc(O)cc(O)c2)cc1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 19 RingCount: 10
HBD: 13 FractionCSP3: 0.3
AlogP: 3.27 Num_rotatable_bonds: 12
MolWt: 1004.99 Num_heavy_atoms: 73
TPSA: 318.37 NumAromaticRings: 6

Unique Aglycone
AD48120
Formula: C42H32O9

Smiles:
Oc1ccc(C=Cc2cc(O)c3c(c2)OC(c2ccc(O)cc2)C3c2cc(O)c3c(c2)OC(c2ccc(O)cc2)C3c2cc(O)cc(O)c2)cc1
HBA: 9 RingCount: 8
HBD: 7 FractionCSP3: 0.1
AlogP: 8.33 Num_rotatable_bonds: 6
MolWt: 680.71 Num_heavy_atoms: 51
TPSA: 160.07 NumAromaticRings: 6

Sugarmoiety
SD00019

OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O