Glycoside
...
GD119433

Name:
1-[1-(benzoyloxy)ethyl]-3a-hydroxy-7-{[5-({4-hydroxy-5-[(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-6-methyloxan-2-yl}oxy)-4-methoxy-6-methyloxan-2-yl]oxy}-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-11-yl benzoate

Formula:
C55H76O15

Smiles:
COC1CC(OC2C(O)CC(OC3C(C)OC(OC4CCC5(C)C(=CCC6C5CC(OC(=O)c5ccccc5)C5(C)C(C(C)OC(=O)c7ccccc7)CCC65O)C4)CC3OC)OC2C)OC(C)C1O

Aglycone:
CC(OC(=O)c1ccccc1)C1CCC2(O)C3CC=C4CC(O)CCC4(C)C3CC(OC(=O)c3ccccc3)C12C

Sugarmoiety:
COC1CC(OC2C(O)CC(OC3C(C)OC(O)CC3OC)OC2C)OC(C)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 9
HBD: 3 FractionCSP3: 0.71
AlogP: 7.07 Num_rotatable_bonds: 13
MolWt: 977.2 Num_heavy_atoms: 70
TPSA: 187.13 NumAromaticRings: 2

Unique Aglycone
AD47847
Formula: C35H42O6

Smiles:
CC(OC(=O)c1ccccc1)C1CCC2(O)C3CC=C4CC(O)CCC4(C)C3CC(OC(=O)c3ccccc3)C12C
HBA: 6 RingCount: 6
HBD: 2 FractionCSP3: 0.54
AlogP: 6.12 Num_rotatable_bonds: 5
MolWt: 558.72 Num_heavy_atoms: 41
TPSA: 93.06 NumAromaticRings: 2

Sugarmoiety
SD01754

COC1CC(OC2C(O)CC(OC3C(C)OC(O)CC3OC)OC2C)OC(C)C1O