Glycoside
...
GD135776

Name:
4,6,8',11'-tetrahydroxy-4',12'-bis(4-hydroxyphenyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3H-5',13'-dioxaspiro[1-benzofuran-2,3'-tricyclo[7.4.0.0²,⁶]tridecane]-1'(9'),2'(6'),7'-trien-3-one

Formula:
C36H32O15

Smiles:
O=C1c2c(cc(O)c(C3OC(CO)C(O)C(O)C3O)c2O)OC12c1c(cc(O)c3c1OC(c1ccc(O)cc1)C(O)C3)OC2c1ccc(O)cc1

Aglycone:
O=C1c2c(O)cc(O)cc2OC12c1c(cc(O)c3c1OC(c1ccc(O)cc1)C(O)C3)OC2c1ccc(O)cc1

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

Other Identifiers

Properties
HBA: 15 RingCount: 8
HBD: 10 FractionCSP3: 0.31
AlogP: 1.37 Num_rotatable_bonds: 4
MolWt: 704.64 Num_heavy_atoms: 51
TPSA: 256.29 NumAromaticRings: 4

Unique Aglycone
AD54897
Formula: C30H22O10

Smiles:
O=C1c2c(O)cc(O)cc2OC12c1c(cc(O)c3c1OC(c1ccc(O)cc1)C(O)C3)OC2c1ccc(O)cc1
HBA: 10 RingCount: 7
HBD: 6 FractionCSP3: 0.17
AlogP: 3.86 Num_rotatable_bonds: 2
MolWt: 542.5 Num_heavy_atoms: 40
TPSA: 166.14 NumAromaticRings: 4

Sugarmoiety
SD00003

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