Glycoside
...
GD003364

Name:
None

Formula:
C32H64O10N4S

Smiles:
CCCCCCCCCCCCCCSC[C@@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@@H]3O[C@H](CN)[C@H](O)[C@H](O)[C@H]3O)[C@@H](N)C[C@H]2N)[C@H](O)[C@H](N)[C@H]1O

Aglycone:
CCCCCCCCCCCCCCSC.NC1CC(N)C(O)C(O)C1O

Sugarmoiety:
NC1C(O)C(O)OC(O)C1O.NCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 14 FractionCSP3: 1.0
AlogP: -0.85 Num_rotatable_bonds: 20
MolWt: 696.95 Num_heavy_atoms: 47
TPSA: 262.38 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
AD01181
Formula: C15H32S

Smiles:
CCCCCCCCCCCCCCSC
HBA: 0 RingCount: 0
HBD: 0 FractionCSP3: 1.0
AlogP: 6.05 Num_rotatable_bonds: 13
MolWt: 244.49 Num_heavy_atoms: 16
TPSA: 0.0 NumAromaticRings: 0

Sugarmoiety
SD00503

NC1C(O)C(O)OC(O)C1O.NCC1OC(O)C(O)C(O)C1O