Glycoside
...
GD014819

Name:
None

Formula:
C40H72O13N2

Smiles:
CCCN1C(=O)O[C@@H]2[C@H](O[C@@H]3[C@H](C)[C@H](O[C@@H]4C[C@@](C)(OC)[C@H](O)[C@H](C)O4)[C@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@H](C)N(C)C[C@H](C)C[C@]3(C)O)O[C@H](C)C[C@H]21

Aglycone:
CCCN1C(=O)OC2C(OC3C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)N(C)CC(C)CC3(C)O)OC(C)CC21

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

Other Identifiers

Properties
HBA: 15 RingCount: 4
HBD: 4 FractionCSP3: 0.95
AlogP: 3.21 Num_rotatable_bonds: 8
MolWt: 789.02 Num_heavy_atoms: 55
TPSA: 186.15 NumAromaticRings: 0

Unique Aglycone
AD10856
Formula: C32H58O10N2

Smiles:
CCCN1C(=O)OC2C(OC3C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)N(C)CC(C)CC3(C)O)OC(C)CC21
HBA: 12 RingCount: 3
HBD: 4 FractionCSP3: 0.94
AlogP: 2.28 Num_rotatable_bonds: 5
MolWt: 630.82 Num_heavy_atoms: 44
TPSA: 158.46 NumAromaticRings: 0

Sugarmoiety
SD00005

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