Glycoside
...
GD152970

Name:
2-(2,7-dihydroxy-3a,6,6,9b,11a-pentamethyl-10-oxo-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]phenanthren-1-yl)-2-methyl-5-(propan-2-yl)-2,3-dihydrofuran-3-one

Formula:
C36H54O11

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: 6 FractionCSP3: 0.83
AlogP: 1.8 Num_rotatable_bonds: 5
MolWt: 662.82 Num_heavy_atoms: 47
TPSA: 183.21 NumAromaticRings: 0

Unique Aglycone
AD60865
Formula: C30H44O6

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: 3 FractionCSP3: 0.8
AlogP: 3.97 Num_rotatable_bonds: 2
MolWt: 500.68 Num_heavy_atoms: 36
TPSA: 104.06 NumAromaticRings: 0

Sugarmoiety
SD00003

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