Glycoside
...
GD030929

Name:
None

Formula:
C43H62O15

Smiles:
COC1=C2C[C@H](O)CC[C@@]2(C)[C@@H]2CC[C@]3(C)[C@H](C[C@H](O[C@@H]4OC[C@H](O)[C@H](O[C@@H]5OC[C@H](O)[C@H](O)[C@H]5OC(=O)c5ccc(OC)cc5)[C@H]4OC(C)=O)[C@@]3(O)C(C)C)[C@H]2C1

Aglycone:
COC1=C2CC(O)CCC2(C)C2CCC3(C)C(CC(O)C3(O)C(C)C)C2C1.COc1ccc(C(=O)O)cc1

Sugarmoiety:
CC(=O)OC1C(O)OCC(O)C1OC1OCC(O)C(O)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 7
HBD: 5 FractionCSP3: 0.77
AlogP: 3.01 Num_rotatable_bonds: 10
MolWt: 818.95 Num_heavy_atoms: 58
TPSA: 209.13 NumAromaticRings: 1

Unique Aglycone
AD01329
Formula: C8H8O3

Smiles:
COc1ccc(C(=O)O)cc1
HBA: 3 RingCount: 1
HBD: 1 FractionCSP3: 0.12
AlogP: 1.39 Num_rotatable_bonds: 2
MolWt: 152.15 Num_heavy_atoms: 11
TPSA: 46.53 NumAromaticRings: 1
AD19989
Formula: C23H38O4

Smiles:
COC1=C2CC(O)CCC2(C)C2CCC3(C)C(CC(O)C3(O)C(C)C)C2C1
HBA: 4 RingCount: 4
HBD: 3 FractionCSP3: 0.91
AlogP: 3.64 Num_rotatable_bonds: 2
MolWt: 378.55 Num_heavy_atoms: 27
TPSA: 69.92 NumAromaticRings: 0

Sugarmoiety
SD00355

CC(=O)OC1C(O)OCC(O)C1OC1OCC(O)C(O)C1O