Glycoside
...
GD143125

Name:
2-[(4-{[6-({[3,4-dihydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-5-hydroxy-2-{[8-hydroxy-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14b-octadecahydropicen-3-yl]oxy}-6-methyloxan-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

Formula:
C60H98O28

Smiles:
CC1OC(OC2CCC3(C)C4=CC=C5C6CC(C)(C)CCC6(CO)C(O)CC5(C)C4(C)CCC3C2(C)CO)C(OC2OC(CO)C(O)C(O)C2O)C(OC2OC(COC3OC(CO)C(OC4OC(CO)C(O)C(O)C4O)C(O)C3O)C(O)C(O)C2O)C1O

Aglycone:
CC1(C)CCC2(CO)C(O)CC3(C)C(=CC=C4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1

Sugarmoiety:
CC1OC(O)C(OC2OC(CO)C(O)C(O)C2O)C(OC2OC(COC3OC(CO)C(OC4OC(CO)C(O)C(O)C4O)C(O)C3O)C(O)C(O)C2O)C1O

Other Identifiers

Properties
HBA: 28 RingCount: 10
HBD: 18 FractionCSP3: 0.93
AlogP: -4.85 Num_rotatable_bonds: 16
MolWt: 1267.42 Num_heavy_atoms: 88
TPSA: 456.44 NumAromaticRings: 0

Unique Aglycone
AD06950
Formula: C30H48O4

Smiles:
CC1(C)CCC2(CO)C(O)CC3(C)C(=CC=C4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1
HBA: 4 RingCount: 5
HBD: 4 FractionCSP3: 0.87
AlogP: 5.0 Num_rotatable_bonds: 2
MolWt: 472.71 Num_heavy_atoms: 34
TPSA: 80.92 NumAromaticRings: 0

Sugarmoiety
SD06376

CC1OC(O)C(OC2OC(CO)C(O)C(O)C2O)C(OC2OC(COC3OC(CO)C(OC4OC(CO)C(O)C(O)C4O)C(O)C3O)C(O)C(O)C2O)C1O