Glycoside
...
GD017534

Name:
None

Formula:
C36H65O13N

Smiles:
CC[C@@H]1OC(=O)[C@H](C)[C@H](O[C@@H]2C[C@@](C)(OC)[C@H](O)[C@H](C)O2)[C@H](C)[C@H](O[C@@H]2O[C@H](C)C[C@H](N)[C@H]2O)[C@@](C)(OC)C[C@H](C)C(=O)[C@H](C)[C@H](O)[C@]1(C)O

Aglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N)C2O)C(C)(OC)CC(C)C(=O)C(C)C(O)C1(C)O

Sugarmoiety:
COC1(C)CC(O)OC(C)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 6 FractionCSP3: 0.94
AlogP: 1.84 Num_rotatable_bonds: 7
MolWt: 719.91 Num_heavy_atoms: 50
TPSA: 205.69 NumAromaticRings: 0

Unique Aglycone
AD12501
Formula: C28H51O10N

Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N)C2O)C(C)(OC)CC(C)C(=O)C(C)C(O)C1(C)O
HBA: 11 RingCount: 2
HBD: 6 FractionCSP3: 0.93
AlogP: 0.91 Num_rotatable_bonds: 4
MolWt: 561.71 Num_heavy_atoms: 39
TPSA: 178.0 NumAromaticRings: 0

Sugarmoiety
SD00005

COC1(C)CC(O)OC(C)C1O