Glycoside
...
GD004142

Name:
None

Formula:
C21H44O10N6

Smiles:
CC1OC(OC2C(N)CC(N)C(OC3OC(CN)C(O)C(O)C3N)C2O)C(O)C(O)C1OC[C@H](N)CN

Aglycone:
NC1CC(N)C(O)C(O)C1O.NCC(N)CO

Sugarmoiety:
CC1OC(O)C(O)C(O)C1O.NCC1OC(O)C(N)C(O)C1O

Other Identifiers

Properties
HBA: 16 RingCount: 3
HBD: 17 FractionCSP3: 1.0
AlogP: -6.95 Num_rotatable_bonds: 9
MolWt: 540.62 Num_heavy_atoms: 37
TPSA: 303.42 NumAromaticRings: 0

Unique Aglycone
AD00009
Formula: C6H14O3N2

Smiles:
NC1CC(N)C(O)C(O)C1O
HBA: 5 RingCount: 1
HBD: 7 FractionCSP3: 1.0
AlogP: -2.87 Num_rotatable_bonds: 0
MolWt: 162.19 Num_heavy_atoms: 11
TPSA: 112.73 NumAromaticRings: 0
AD03661
Formula: C3H10ON2

Smiles:
NCC(N)CO
HBA: 3 RingCount: 0
HBD: 5 FractionCSP3: 1.0
AlogP: -1.74 Num_rotatable_bonds: 2
MolWt: 90.13 Num_heavy_atoms: 6
TPSA: 72.27 NumAromaticRings: 0

Sugarmoiety
SD00827

CC1OC(O)C(O)C(O)C1O.NCC1OC(O)C(N)C(O)C1O