Glycoside
...
GD021548

Name:
7-O- Î’-D-Galactosyl-Brefeldin A

Formula:
C22H34O9

Smiles:
C[C@@H]1CCCC=C[C@@H]2C[C@H](OC3OC(CO)C(O)C(O)C3O)C[C@H]2[C@H](O)C=CC(=O)O1

Aglycone:
CC1CCCC=CC2CC(O)CC2C(O)C=CC(=O)O1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 3
HBD: 5 FractionCSP3: 0.77
AlogP: -0.21 Num_rotatable_bonds: 3
MolWt: 442.51 Num_heavy_atoms: 31
TPSA: 145.91 NumAromaticRings: 0

Unique Aglycone
AD12105
Formula: C16H24O4

Smiles:
CC1CCCC=CC2CC(O)CC2C(O)C=CC(=O)O1
HBA: 4 RingCount: 2
HBD: 2 FractionCSP3: 0.69
AlogP: 1.96 Num_rotatable_bonds: 0
MolWt: 280.36 Num_heavy_atoms: 20
TPSA: 66.76 NumAromaticRings: 0

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O