Glycoside
...
GD107054

Name:
4-{[5-({5-[(5-{[3-(acetyloxy)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-yl)oxy]-4-methoxy-6-methyloxan-2-yl}oxy)-4-methoxy-6-methyloxan-2-yl]oxy}-3-methoxy-4-(3-oxooxiran-2-yl)butanoic acid

Formula:
C37H60O20

Smiles:
CO[C@H]1[C@@H](O)[C@@H](C)O[C@@H](O[C@H]2[C@@H](OC)C[C@H](O[C@H]3[C@@H](OC)C[C@H](O[C@H]4[C@@H](OC)C[C@H](O[C@H]([C@@H]5OC5=O)[C@@H](CC(=O)O)OC)O[C@@H]4C)O[C@@H]3C)O[C@@H]2C)[C@@H]1OC(C)=O

Aglycone:
COC(CC(=O)O)C(O)C1OC1=O

Sugarmoiety:
COC1CC(O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3OC(C)C(O)C(OC)C3OC(C)=O)C(C)O2)C(C)O1

Other Identifiers

Properties
HBA: 20 RingCount: 5
HBD: 2 FractionCSP3: 0.92
AlogP: 0.44 Num_rotatable_bonds: 18
MolWt: 824.87 Num_heavy_atoms: 57
TPSA: 233.42 NumAromaticRings: 0

Unique Aglycone
AD44267
Formula: C7H10O6

Smiles:
COC(CC(=O)O)C(O)C1OC1=O
HBA: 6 RingCount: 1
HBD: 2 FractionCSP3: 0.71
AlogP: -1.24 Num_rotatable_bonds: 5
MolWt: 190.15 Num_heavy_atoms: 13
TPSA: 96.36 NumAromaticRings: 0

Sugarmoiety
SD02889

COC1CC(O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3OC(C)C(O)C(OC)C3OC(C)=O)C(C)O2)C(C)O1