Glycoside
...
GD148468

Name:
1-acetyl-3a,3b-dihydroxy-7-[(5-{[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}-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 acetate

Formula:
C50H80O18

Smiles:
COC1CC(OC2C(O)CC(OC3C(C)OC(OC4C(C)OC(OC5CCC6(C)C(=CCC7(O)C6CC(OC(C)=O)C6(C)C(C(C)=O)CCC76O)C5)CC4OC)CC3OC)OC2C)OC(C)C1O

Aglycone:
CC(=O)OC1CC2C3(C)CCC(O)CC3=CCC2(O)C2(O)CCC(C(C)=O)C12C

Sugarmoiety:
COC1CC(OC2C(O)CC(OC3C(C)OC(OC4C(C)OC(O)CC4OC)CC3OC)OC2C)OC(C)C1O

Other Identifiers

Properties
HBA: 18 RingCount: 8
HBD: 4 FractionCSP3: 0.92
AlogP: 3.77 Num_rotatable_bonds: 13
MolWt: 969.17 Num_heavy_atoms: 68
TPSA: 225.82 NumAromaticRings: 0

Unique Aglycone
AD49986
Formula: C23H34O6

Smiles:
CC(=O)OC1CC2C3(C)CCC(O)CC3=CCC2(O)C2(O)CCC(C(C)=O)C12C
HBA: 6 RingCount: 4
HBD: 3 FractionCSP3: 0.83
AlogP: 2.29 Num_rotatable_bonds: 2
MolWt: 406.52 Num_heavy_atoms: 29
TPSA: 104.06 NumAromaticRings: 0

Sugarmoiety
SD04333

COC1CC(OC2C(O)CC(OC3C(C)OC(OC4C(C)OC(O)CC4OC)CC3OC)OC2C)OC(C)C1O