Glycoside
...
GD118305

Name:
methyl 2-(1-hydroxy-5-{[2-hydroxy-3-(4-hydroxyphenyl)propanoyl]oxy}-4a-methyl-8-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-decahydronaphthalen-2-yl)prop-2-enoate

Formula:
C31H44O13

Smiles:
C=C(C(=O)OC)C1CCC2(C)C(OC(=O)C(O)Cc3ccc(O)cc3)CCC(COC3OC(CO)C(O)C(O)C3O)C2C1O

Aglycone:
C=C(C(=O)OC)C1CCC2(C)C(OC(=O)C(O)Cc3ccc(O)cc3)CCC(CO)C2C1O

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

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 7 FractionCSP3: 0.68
AlogP: -0.44 Num_rotatable_bonds: 10
MolWt: 624.68 Num_heavy_atoms: 44
TPSA: 212.67 NumAromaticRings: 1

Unique Aglycone
AD47289
Formula: C25H34O8

Smiles:
C=C(C(=O)OC)C1CCC2(C)C(OC(=O)C(O)Cc3ccc(O)cc3)CCC(CO)C2C1O
HBA: 8 RingCount: 3
HBD: 4 FractionCSP3: 0.6
AlogP: 1.73 Num_rotatable_bonds: 7
MolWt: 462.54 Num_heavy_atoms: 33
TPSA: 133.52 NumAromaticRings: 1

Sugarmoiety
SD00003

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