Glycoside
...
GD132784

Name:
2-{[2-({16-[(4,5-dihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl}oxy)-4-hydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

Formula:
C56H94O31

Smiles:
C=CC(C)(CCC=C(C)CCC=C(C)CCC=C(C)COC1OC(COC2OC(C)C(O)C(O)C2O)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O)OC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC1OC(CO)C(O)C(O)C1O

Aglycone:
C=CC(C)(O)CCC=C(C)CCC=C(C)CCC=C(C)CO

Sugarmoiety:
CC1OC(OCC2OC(O)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O.OCC1OC(OC2C(O)OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 31 RingCount: 6
HBD: 19 FractionCSP3: 0.86
AlogP: -6.93 Num_rotatable_bonds: 28
MolWt: 1263.34 Num_heavy_atoms: 87
TPSA: 495.13 NumAromaticRings: 0

Unique Aglycone
AD03073
Formula: C20H34O2

Smiles:
C=CC(C)(O)CCC=C(C)CCC=C(C)CCC=C(C)CO
HBA: 2 RingCount: 0
HBD: 2 FractionCSP3: 0.6
AlogP: 5.1 Num_rotatable_bonds: 11
MolWt: 306.49 Num_heavy_atoms: 22
TPSA: 40.46 NumAromaticRings: 0

Sugarmoiety
SD07567

CC1OC(OCC2OC(O)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O.OCC1OC(OC2C(O)OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C2O)C(O)C(O)C1O