Glycoside
...
GD014626

Name:
None

Formula:
C40H74O13N2

Smiles:
CCCON=C1[C@H](C)[C@H](O)[C@@](C)(O)[C@H](CC)OC(=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)C)[C@H]2O)[C@@](C)(O)C[C@H]1C

Aglycone:
CCCON=C1C(C)CC(C)(O)C(OC2OC(C)CC(N(C)C)C2O)C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C1C

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

Other Identifiers

Properties
HBA: 15 RingCount: 3
HBD: 5 FractionCSP3: 0.95
AlogP: 3.0 Num_rotatable_bonds: 10
MolWt: 791.03 Num_heavy_atoms: 55
TPSA: 198.43 NumAromaticRings: 0

Unique Aglycone
AD10730
Formula: C32H60O10N2

Smiles:
CCCON=C1C(C)CC(C)(O)C(OC2OC(C)CC(N(C)C)C2O)C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C1C
HBA: 12 RingCount: 2
HBD: 5 FractionCSP3: 0.94
AlogP: 2.07 Num_rotatable_bonds: 7
MolWt: 632.84 Num_heavy_atoms: 44
TPSA: 170.74 NumAromaticRings: 0

Sugarmoiety
SD00005

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