Glycoside
...
GD150484

Name:
2-[3,4-dihydroxy-5-({4-[(phenylsulfanyl)methyl]-1H-1,2,3-triazol-1-yl}methyl)oxolan-2-yl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethan-1-one

Formula:
C26H30O4N5FS

Smiles:
O=C(CC1OC(Cn2cc(CSc3ccccc3)nn2)C(O)C1O)N1CCN(c2ccc(F)cc2)CC1

Aglycone:
CC(=O)N1CCN(c2ccc(F)cc2)CC1.Cn1cc(CSc2ccccc2)nn1

Sugarmoiety:
OC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 5
HBD: 2 FractionCSP3: 0.42
AlogP: 1.94 Num_rotatable_bonds: 8
MolWt: 527.62 Num_heavy_atoms: 37
TPSA: 103.95 NumAromaticRings: 3

Unique Aglycone
AD21326
Formula: C12H15ON2F

Smiles:
CC(=O)N1CCN(c2ccc(F)cc2)CC1
HBA: 3 RingCount: 2
HBD: 0 FractionCSP3: 0.42
AlogP: 1.49 Num_rotatable_bonds: 1
MolWt: 222.26 Num_heavy_atoms: 16
TPSA: 23.55 NumAromaticRings: 1
AD32460
Formula: C10H11N3S

Smiles:
Cn1cc(CSc2ccccc2)nn1
HBA: 3 RingCount: 2
HBD: 0 FractionCSP3: 0.2
AlogP: 2.11 Num_rotatable_bonds: 3
MolWt: 205.29 Num_heavy_atoms: 14
TPSA: 30.71 NumAromaticRings: 2

Sugarmoiety
SD00018

OC1OC(O)C(O)C1O