Glycoside
...
GD120811

Name:
2-hydroxy-3a,6,6,9b,11a-pentamethyl-1-[2-methyl-3-oxo-5-(propan-2-yl)-2,3-dihydrofuran-2-yl]-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-7,10-dione

Formula:
C36H52O11

Smiles:
CC(C)C1=CC(=O)C(C)(C2C(O)CC3(C)C4CC=C5C(CC(OC6OC(CO)C(O)C(O)C6O)C(=O)C5(C)C)C4(C)C(=O)CC23C)O1

Aglycone:
CC(C)C1=CC(=O)C(C)(C2C(O)CC3(C)C4CC=C5C(CC(O)C(=O)C5(C)C)C4(C)C(=O)CC23C)O1

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

Other Identifiers

Properties
HBA: 11 RingCount: 6
HBD: 5 FractionCSP3: 0.81
AlogP: 2.0 Num_rotatable_bonds: 5
MolWt: 660.8 Num_heavy_atoms: 47
TPSA: 180.05 NumAromaticRings: 0

Unique Aglycone
AD48576
Formula: C30H42O6

Smiles:
CC(C)C1=CC(=O)C(C)(C2C(O)CC3(C)C4CC=C5C(CC(O)C(=O)C5(C)C)C4(C)C(=O)CC23C)O1
HBA: 6 RingCount: 5
HBD: 2 FractionCSP3: 0.77
AlogP: 4.18 Num_rotatable_bonds: 2
MolWt: 498.66 Num_heavy_atoms: 36
TPSA: 100.9 NumAromaticRings: 0

Sugarmoiety
SD00003

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