Glycoside
...
GD122102

Name:
5-({[3,4-dihydroxy-6-(hydroxymethyl)-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}methyl)-2,3,4-trihydroxycyclohexyl 9-({4,5-dihydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-8-ethyl-5a,5b,8,11a-tetramethyl-1-(prop-1-en-2-yl)-icosahydro-1H-cyclopenta[a]chrysene-3a-carboxylate

Formula:
C61H100O24

Smiles:
C=C(C)C1CCC2(C(=O)OC3CC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(CCC4C5(C)CCC(OC6OCC(O)C(O)C6OC6OC(C)C(O)C(O)C6O)C(C)(CC)C5CCC43C)C12

Aglycone:
C=C(C)C1CCC2(C(=O)OC3CC(CO)C(O)C(O)C3O)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(CC)C5CCC43C)C12

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

Other Identifiers

Properties
HBA: 24 RingCount: 10
HBD: 14 FractionCSP3: 0.95
AlogP: -0.61 Num_rotatable_bonds: 14
MolWt: 1217.45 Num_heavy_atoms: 85
TPSA: 383.36 NumAromaticRings: 0

Unique Aglycone
AD49185
Formula: C38H62O7

Smiles:
C=C(C)C1CCC2(C(=O)OC3CC(CO)C(O)C(O)C3O)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(CC)C5CCC43C)C12
HBA: 7 RingCount: 6
HBD: 5 FractionCSP3: 0.92
AlogP: 5.4 Num_rotatable_bonds: 5
MolWt: 630.91 Num_heavy_atoms: 45
TPSA: 127.45 NumAromaticRings: 0

Sugarmoiety
SD05926

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