Glycoside
...
GD125422

Name:
Viscumneoside I

Formula:
C27H32O15

Smiles:
COc1cc(C2CC(=O)c3c(O)cc(OC4OC(CO)C(O)C(O)C4O)cc3O2)ccc1OC1OCC(O)(CO)C1O

Aglycone:
COc1cc(C2CC(=O)c3c(O)cc(O)cc3O2)ccc1O

Sugarmoiety:
OCC1(O)COC(O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 5
HBD: 8 FractionCSP3: 0.52
AlogP: -1.89 Num_rotatable_bonds: 8
MolWt: 596.54 Num_heavy_atoms: 42
TPSA: 234.29 NumAromaticRings: 2

Unique Aglycone
AD04775
Formula: C16H14O6

Smiles:
COc1cc(C2CC(=O)c3c(O)cc(O)cc3O2)ccc1O
HBA: 6 RingCount: 3
HBD: 3 FractionCSP3: 0.19
AlogP: 2.52 Num_rotatable_bonds: 2
MolWt: 302.28 Num_heavy_atoms: 22
TPSA: 96.22 NumAromaticRings: 2

Sugarmoiety
SD01212

OCC1(O)COC(O)C1O.OCC1OC(O)C(O)C(O)C1O