Glycoside
...
GD158076

Name:
3-{3,5-dihydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl}-2,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.0⁴,¹⁸.0⁷,¹⁹.0¹¹,¹⁶]nonadeca-4,6,11(16),12,14,18-hexaene-5,13,15-triol

Formula:
C48H42O14

Smiles:
OCC1OC(c2c(O)cc(C3c4c(O)cc5c6c4C(C(c4ccc(O)cc4)c4c(O)cc(O)cc4C6C(c4ccc(O)cc4)O5)C3c3ccc(O)cc3)cc2O)C(O)C(O)C1O

Aglycone:
Oc1ccc(C2Oc3cc(O)c4c5c3C2c2cc(O)cc(O)c2C(c2ccc(O)cc2)C5C(c2ccc(O)cc2)C4c2cc(O)cc(O)c2)cc1

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

Other Identifiers

Properties
HBA: 14 RingCount: 10
HBD: 12 FractionCSP3: 0.25
AlogP: 5.27 Num_rotatable_bonds: 6
MolWt: 842.85 Num_heavy_atoms: 62
TPSA: 261.22 NumAromaticRings: 6

Unique Aglycone
AD57654
Formula: C42H32O9

Smiles:
Oc1ccc(C2Oc3cc(O)c4c5c3C2c2cc(O)cc(O)c2C(c2ccc(O)cc2)C5C(c2ccc(O)cc2)C4c2cc(O)cc(O)c2)cc1
HBA: 9 RingCount: 9
HBD: 8 FractionCSP3: 0.14
AlogP: 7.76 Num_rotatable_bonds: 4
MolWt: 680.71 Num_heavy_atoms: 51
TPSA: 171.07 NumAromaticRings: 6

Sugarmoiety
SD00003

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