Glycoside
...
GD118082

Name:
3-(9a,11a-dimethyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,11H,11aH-cyclopenta[a]phenanthren-1-yl)-6-(1-hydroxyethyl)-6-(propan-2-yl)oxan-2-one

Formula:
C35H54O9

Smiles:
CC(C)C1(C(C)O)CCC(C2CCC3C4=CCC5CC(OC6OC(CO)C(O)C(O)C6O)CCC5(C)C4=CCC32C)C(=O)O1

Aglycone:
CC(C)C1(C(C)O)CCC(C2CCC3C4=CCC5CC(O)CCC5(C)C4=CCC32C)C(=O)O1

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

Other Identifiers

Properties
HBA: 9 RingCount: 6
HBD: 5 FractionCSP3: 0.86
AlogP: 3.4 Num_rotatable_bonds: 6
MolWt: 618.81 Num_heavy_atoms: 44
TPSA: 145.91 NumAromaticRings: 0

Unique Aglycone
AD47170
Formula: C29H44O4

Smiles:
CC(C)C1(C(C)O)CCC(C2CCC3C4=CCC5CC(O)CCC5(C)C4=CCC32C)C(=O)O1
HBA: 4 RingCount: 5
HBD: 2 FractionCSP3: 0.83
AlogP: 5.58 Num_rotatable_bonds: 3
MolWt: 456.67 Num_heavy_atoms: 33
TPSA: 66.76 NumAromaticRings: 0

Sugarmoiety
SD00003

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