Glycoside
...
GD131661

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

Formula:
C44H74O20

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

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

Sugarmoiety:
CC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O.CC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 20 RingCount: 4
HBD: 12 FractionCSP3: 0.82
AlogP: -1.55 Num_rotatable_bonds: 21
MolWt: 923.06 Num_heavy_atoms: 64
TPSA: 316.6 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
SD02471

CC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O.CC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O