Glycoside
...
GD148642

Name:
methyl 4-(1-{[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}ethyl)-5-oxo-7'-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3'a,6',7',7'a-tetrahydro-5H-spiro[furan-2,1'-indene]-4'-carboxylate

Formula:
C31H34O13

Smiles:
COC(=O)C1=CCC(OC2OC(CO)C(O)C(O)C2O)C2C1C=CC21C=C(C(C)OC(=O)C=Cc2ccc(O)cc2)C(=O)O1

Aglycone:
COC(=O)C1=CCC(O)C2C1C=CC21C=C(C(C)OC(=O)C=Cc2ccc(O)cc2)C(=O)O1

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

Other Identifiers

Properties
HBA: 13 RingCount: 5
HBD: 5 FractionCSP3: 0.45
AlogP: 0.05 Num_rotatable_bonds: 8
MolWt: 614.6 Num_heavy_atoms: 44
TPSA: 198.51 NumAromaticRings: 1

Unique Aglycone
AD59468
Formula: C25H24O8

Smiles:
COC(=O)C1=CCC(O)C2C1C=CC21C=C(C(C)OC(=O)C=Cc2ccc(O)cc2)C(=O)O1
HBA: 8 RingCount: 4
HBD: 2 FractionCSP3: 0.32
AlogP: 2.23 Num_rotatable_bonds: 5
MolWt: 452.46 Num_heavy_atoms: 33
TPSA: 119.36 NumAromaticRings: 1

Sugarmoiety
SD00003

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