Glycoside
...
GD118771

Name:
15-hydroxy-5-(1-hydroxyethyl)-3,17-dimethoxy-12-(3,4,5-trihydroxy-4,6-dimethyloxan-2-yl)-9-oxatetracyclo[8.8.0.0²,⁷.0¹¹,¹⁶]octadeca-1(10),2(7),3,5,11,13,15,17-octaen-8-one

Formula:
C28H30O10

Smiles:
COc1cc2c(oc(=O)c3cc(C(C)O)cc(OC)c32)c2c(C3OC(C)C(O)C(C)(O)C3O)ccc(O)c12

Aglycone:
COc1cc2c(oc(=O)c3cc(C(C)O)cc(OC)c32)c2cccc(O)c12

Sugarmoiety:
CC1OC(O)C(O)C(C)(O)C1O

Other Identifiers

Properties
HBA: 10 RingCount: 5
HBD: 5 FractionCSP3: 0.39
AlogP: 2.81 Num_rotatable_bonds: 4
MolWt: 526.54 Num_heavy_atoms: 38
TPSA: 159.05 NumAromaticRings: 4

Unique Aglycone
AD47520
Formula: C21H18O6

Smiles:
COc1cc2c(oc(=O)c3cc(C(C)O)cc(OC)c32)c2cccc(O)c12
HBA: 6 RingCount: 4
HBD: 2 FractionCSP3: 0.19
AlogP: 3.88 Num_rotatable_bonds: 3
MolWt: 366.37 Num_heavy_atoms: 27
TPSA: 89.13 NumAromaticRings: 4

Sugarmoiety
SD00517

CC1OC(O)C(O)C(C)(O)C1O