Glycoside
...
GD146905

Name:
7-methyl-3-oxo-octahydrocyclopenta[c]pyran-6-yl 4-(2,2-dihydroxyethyl)-3-ethenyl-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-pyran-5-carboxylate

Formula:
C25H36O13

Smiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC2CC3CC(=O)OCC3C2C)C1CC(O)O

Aglycone:
C=CC1C(O)OC=C(C(=O)OC2CC3CC(=O)OCC3C2C)C1CC(O)O

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

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 6 FractionCSP3: 0.76
AlogP: -1.71 Num_rotatable_bonds: 8
MolWt: 544.55 Num_heavy_atoms: 38
TPSA: 201.67 NumAromaticRings: 0

Unique Aglycone
AD58865
Formula: C19H26O8

Smiles:
C=CC1C(O)OC=C(C(=O)OC2CC3CC(=O)OCC3C2C)C1CC(O)O
HBA: 8 RingCount: 3
HBD: 3 FractionCSP3: 0.68
AlogP: 0.47 Num_rotatable_bonds: 5
MolWt: 382.41 Num_heavy_atoms: 27
TPSA: 122.52 NumAromaticRings: 0

Sugarmoiety
SD00003

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