Glycoside
...
GD134826

Name:
2-ethyl-9-hydroxy-6-[(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy]-8-{[3-hydroxy-6-methyl-4-(propan-2-yl)oxan-2-yl]oxy}-1,5,7,9,11,13-hexamethyl-3,15-dioxabicyclo[10.2.1]pentadec-12-ene-4,14-dione

Formula:
C38H64O12

Smiles:
CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(C(C)C)C2O)C(C)(O)CC(C)C2=C(C)C(=O)C1(C)O2

Aglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(C(C)C)C2O)C(C)(O)CC(C)C2=C(C)C(=O)C1(C)O2

Sugarmoiety:
COC1(C)CC(O)OC(C)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 4
HBD: 3 FractionCSP3: 0.89
AlogP: 4.44 Num_rotatable_bonds: 7
MolWt: 712.92 Num_heavy_atoms: 50
TPSA: 159.44 NumAromaticRings: 0

Unique Aglycone
AD54535
Formula: C30H50O9

Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(C(C)C)C2O)C(C)(O)CC(C)C2=C(C)C(=O)C1(C)O2
HBA: 9 RingCount: 3
HBD: 3 FractionCSP3: 0.87
AlogP: 3.52 Num_rotatable_bonds: 4
MolWt: 554.72 Num_heavy_atoms: 39
TPSA: 131.75 NumAromaticRings: 0

Sugarmoiety
SD00005

COC1(C)CC(O)OC(C)C1O