Glycoside
...
GD124207

Name:
1-acetyl-10-(acetyloxy)-3a-hydroxy-7-[(5-{[5-({5-[(3-hydroxy-4-methoxy-6-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-4-methoxy-6-methyloxan-2-yl}oxy)-4-methoxy-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-yl)oxy]-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-11-yl 3-phenylprop-2-enoate

Formula:
C66H100O25

Smiles:
COC1CC(OC2CCC3(C)C(CCC4C3C(OC(C)=O)C(OC(=O)C=Cc3ccccc3)C3(C)C(C(C)=O)CCC43O)C2)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3OC(C)C(OC4OC(CO)C(O)C(O)C4O)C(OC)C3O)C(C)O2)C(C)O1

Aglycone:
CC(=O)OC1C2C(CCC3CC(O)CCC32C)C2(O)CCC(C(C)=O)C2(C)C1OC(=O)C=Cc1ccccc1

Sugarmoiety:
COC1CC(O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3OC(C)C(OC4OC(CO)C(O)C(O)C4O)C(OC)C3O)C(C)O2)C(C)O1

Other Identifiers

Properties
HBA: 25 RingCount: 10
HBD: 6 FractionCSP3: 0.83
AlogP: 3.42 Num_rotatable_bonds: 20
MolWt: 1293.5 Num_heavy_atoms: 91
TPSA: 320.27 NumAromaticRings: 1

Unique Aglycone
AD50162
Formula: C32H42O7

Smiles:
CC(=O)OC1C2C(CCC3CC(O)CCC32C)C2(O)CCC(C(C)=O)C2(C)C1OC(=O)C=Cc1ccccc1
HBA: 7 RingCount: 5
HBD: 2 FractionCSP3: 0.66
AlogP: 4.49 Num_rotatable_bonds: 5
MolWt: 538.68 Num_heavy_atoms: 39
TPSA: 110.13 NumAromaticRings: 1

Sugarmoiety
SD00904

COC1CC(O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3OC(C)C(OC4OC(CO)C(O)C(O)C4O)C(OC)C3O)C(C)O2)C(C)O1