Glycoside
...
GD119717

Name:
2-{[16-hydroxy-2,6,6,10,16-pentamethyl-17-(2-methylprop-1-en-1-yl)-19,21-dioxahexacyclo[18.2.1.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0¹⁵,²⁰]tricosan-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

Formula:
C36H58O9

Smiles:
CC(C)=CC1COC23CC4(CO2)C(CCC2C5(C)CCC(OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC24C)C3C1(C)O

Aglycone:
CC(C)=CC1COC23CC4(CO2)C(CCC2C5(C)CCC(O)C(C)(C)C5CCC24C)C3C1(C)O

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 7
HBD: 5 FractionCSP3: 0.94
AlogP: 3.54 Num_rotatable_bonds: 4
MolWt: 634.85 Num_heavy_atoms: 45
TPSA: 138.07 NumAromaticRings: 0

Unique Aglycone
AD02018
Formula: C30H48O4

Smiles:
CC(C)=CC1COC23CC4(CO2)C(CCC2C5(C)CCC(O)C(C)(C)C5CCC24C)C3C1(C)O
HBA: 4 RingCount: 6
HBD: 2 FractionCSP3: 0.93
AlogP: 5.71 Num_rotatable_bonds: 1
MolWt: 472.71 Num_heavy_atoms: 34
TPSA: 58.92 NumAromaticRings: 0

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O