Glycoside
...
GD131651

Name:
18-({4,5-dihydroxy-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl}oxy)-15-hydroxy-4,6,12,17,17-pentamethyl-9-oxahexacyclo[11.9.0.0¹,²¹.0⁴,¹².0⁵,¹⁰.0¹⁶,²¹]docosan-8-one

Formula:
C36H56O12

Smiles:
CC1CC(=O)OC2CC3(C)C4CC(O)C5C(C)(C)C(OC6OCC(O)C(O)C6OC6OCC(O)C(O)C6O)CCC56CC46CCC3(C)C12

Aglycone:
CC1CC(=O)OC2CC3(C)C4CC(O)C5C(C)(C)C(O)CCC56CC46CCC3(C)C12

Sugarmoiety:
OC1COC(OC2C(O)OCC(O)C2O)C(O)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 8
HBD: 6 FractionCSP3: 0.97
AlogP: 1.25 Num_rotatable_bonds: 4
MolWt: 680.83 Num_heavy_atoms: 48
TPSA: 184.6 NumAromaticRings: 0

Unique Aglycone
AD53322
Formula: C26H40O4

Smiles:
CC1CC(=O)OC2CC3(C)C4CC(O)C5C(C)(C)C(O)CCC56CC46CCC3(C)C12
HBA: 4 RingCount: 6
HBD: 2 FractionCSP3: 0.96
AlogP: 4.32 Num_rotatable_bonds: 0
MolWt: 416.6 Num_heavy_atoms: 30
TPSA: 66.76 NumAromaticRings: 0

Sugarmoiety
SD01175

OC1COC(OC2C(O)OCC(O)C2O)C(O)C1O