Glycoside
...
GD137195

Name:
4-(hydroxymethyl)-4'-(propan-2-yl)-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]peroxy}-4a,5,6,7a-tetrahydro-1H,5'H-spiro[cyclopenta[c]pyran-7,2'-furan]-5'-one

Formula:
C21H30O11

Smiles:
CC(C)C1=CC2(CCC3C(CO)=COC(OOC4OC(CO)C(O)C(O)C4O)C32)OC1=O

Aglycone:
CC(C)C1=CC2(CCC3C(CO)=COC(OO)C32)OC1=O

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

Other Identifiers

Properties
HBA: 11 RingCount: 4
HBD: 5 FractionCSP3: 0.76
AlogP: -1.13 Num_rotatable_bonds: 6
MolWt: 458.46 Num_heavy_atoms: 32
TPSA: 164.37 NumAromaticRings: 0

Unique Aglycone
AD55439
Formula: C15H20O6

Smiles:
CC(C)C1=CC2(CCC3C(CO)=COC(OO)C32)OC1=O
HBA: 6 RingCount: 3
HBD: 2 FractionCSP3: 0.67
AlogP: 1.61 Num_rotatable_bonds: 3
MolWt: 296.32 Num_heavy_atoms: 21
TPSA: 85.22 NumAromaticRings: 0

Sugarmoiety
SD00003

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