Glycoside
...
GD127584

Name:
None

Formula:
C35H33O16

Smiles:
COc1cc(C2Oc3cc(O)cc4c3C(=C2OC2OC(COC(=O)C=Cc3ccc([OH2+])cc3)C(O)C(O)C2O)C=C(C(=O)O)O4)cc(OC)c1O

Aglycone:
COC(=O)C=Cc1ccc([OH2+])cc1.COc1cc(C2Oc3cc(O)cc4c3C(=C2O)C=C(C(=O)O)O4)cc(OC)c1O

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

Other Identifiers

Properties
HBA: 16 RingCount: 6
HBD: 8 FractionCSP3: 0.26
AlogP: 1.84 Num_rotatable_bonds: 10
MolWt: 709.63 Num_heavy_atoms: 51
TPSA: 243.03 NumAromaticRings: 3

Unique Aglycone
AD45655
Formula: C10H11O3

Smiles:
COC(=O)C=Cc1ccc([OH2+])cc1
HBA: 3 RingCount: 1
HBD: 2 FractionCSP3: 0.1
AlogP: 1.31 Num_rotatable_bonds: 2
MolWt: 179.19 Num_heavy_atoms: 13
TPSA: 49.2 NumAromaticRings: 1
AD51668
Formula: C20H16O9

Smiles:
COc1cc(C2Oc3cc(O)cc4c3C(=C2O)C=C(C(=O)O)O4)cc(OC)c1O
HBA: 9 RingCount: 4
HBD: 4 FractionCSP3: 0.15
AlogP: 2.88 Num_rotatable_bonds: 4
MolWt: 400.34 Num_heavy_atoms: 29
TPSA: 134.91 NumAromaticRings: 2

Sugarmoiety
SD00017

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