Glycoside
...
GD114800

Name:
2-[(2-{[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl]oxy}-7-hydroxy-8-(5-hydroxy-4-methylpent-3-en-1-yl)-8-(hydroxymethyl)-1,4a,10a,10b-tetramethyl-octadecahydrochrysen-1-yl)methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

Formula:
C47H80O19

Smiles:
CC(=CCCC1(CO)CCC2(C)C(CCC3C4(C)CCC(OC5OC(CO)C(O)C(O)C5OC5OCC(O)C(O)C5O)C(C)(COC5OC(CO)C(O)C(O)C5O)C4CCC32C)C1O)CO

Aglycone:
CC(=CCCC1(CO)CCC2(C)C(CCC3C4(C)CCC(O)C(C)(CO)C4CCC32C)C1O)CO

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(OC2OCC(O)C(O)C2O)C(O)C1O

Other Identifiers

Properties
HBA: 19 RingCount: 7
HBD: 13 FractionCSP3: 0.96
AlogP: -1.44 Num_rotatable_bonds: 14
MolWt: 949.14 Num_heavy_atoms: 66
TPSA: 318.37 NumAromaticRings: 0

Unique Aglycone
AD45291
Formula: C30H52O5

Smiles:
CC(=CCCC1(CO)CCC2(C)C(CCC3C4(C)CCC(O)C(C)(CO)C4CCC32C)C1O)CO
HBA: 5 RingCount: 4
HBD: 5 FractionCSP3: 0.93
AlogP: 4.45 Num_rotatable_bonds: 6
MolWt: 492.74 Num_heavy_atoms: 35
TPSA: 101.15 NumAromaticRings: 0

Sugarmoiety
SD00544

OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(OC2OCC(O)C(O)C2O)C(O)C1O