Glycoside
...
GD146235

Name:
7-[(5-{[3,4-dihydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-3a-hydroxy-9a,11a-dimethyl-1-(5-oxo-2,5-dihydrofuran-3-yl)-hexadecahydro-1H-cyclopenta[a]phenanthren-2-yl acetate

Formula:
C44H68O20

Smiles:
COC1C(O)C(OC2CCC3(C)C(CCC4C3CCC3(C)C(C5=CC(=O)OC5)C(OC(C)=O)CC43O)C2)OC(C)C1OC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O

Aglycone:
CC(=O)OC1CC2(O)C3CCC4CC(O)CCC4(C)C3CCC2(C)C1C1=CC(=O)OC1

Sugarmoiety:
COC1C(O)C(O)OC(C)C1OC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O

Other Identifiers

Properties
HBA: 20 RingCount: 8
HBD: 9 FractionCSP3: 0.91
AlogP: -1.7 Num_rotatable_bonds: 11
MolWt: 917.01 Num_heavy_atoms: 64
TPSA: 299.28 NumAromaticRings: 0

Unique Aglycone
AD01727
Formula: C25H36O6

Smiles:
CC(=O)OC1CC2(O)C3CCC4CC(O)CCC4(C)C3CCC2(C)C1C1=CC(=O)OC1
HBA: 6 RingCount: 5
HBD: 2 FractionCSP3: 0.84
AlogP: 3.15 Num_rotatable_bonds: 2
MolWt: 432.56 Num_heavy_atoms: 31
TPSA: 93.06 NumAromaticRings: 0

Sugarmoiety
SD06362

COC1C(O)C(O)OC(C)C1OC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O