Glycoside
...
GD100952

Name:
None

Formula:
C20H29O6N2Br

Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)C2CCN(c3cccc(Br)c3)CC2)[C@@H](O)[C@H](O)[C@@H]1O

Aglycone:
O=C(NCCO)C1CCN(c2cccc(Br)c2)CC1

Sugarmoiety:
CC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 8 RingCount: 3
HBD: 4 FractionCSP3: 0.65
AlogP: 0.63 Num_rotatable_bonds: 6
MolWt: 473.36 Num_heavy_atoms: 29
TPSA: 111.49 NumAromaticRings: 1

Unique Aglycone
AD42666
Formula: C14H19O2N2Br

Smiles:
O=C(NCCO)C1CCN(c2cccc(Br)c2)CC1
HBA: 4 RingCount: 2
HBD: 2 FractionCSP3: 0.5
AlogP: 1.77 Num_rotatable_bonds: 4
MolWt: 327.22 Num_heavy_atoms: 19
TPSA: 52.57 NumAromaticRings: 1

Sugarmoiety
SD00076

CC1OC(O)C(O)C(O)C1O