Glycoside
...
GD021912

Name:
None

Formula:
C39H72O12N2

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)C)[C@H]2O)[C@@](C)(O)C[C@H](C)[C@H](N(C)C)[C@H](C)[C@H](O)[C@@]12CO2

Aglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(N(C)C)C(C)C(O)C12CO2

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

Other Identifiers

Properties
HBA: 14 RingCount: 4
HBD: 4 FractionCSP3: 0.97
AlogP: 2.16 Num_rotatable_bonds: 8
MolWt: 761.01 Num_heavy_atoms: 53
TPSA: 172.38 NumAromaticRings: 0

Unique Aglycone
AD14910
Formula: C31H58O9N2

Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(N(C)C)C(C)C(O)C12CO2
HBA: 11 RingCount: 3
HBD: 4 FractionCSP3: 0.97
AlogP: 1.24 Num_rotatable_bonds: 5
MolWt: 602.81 Num_heavy_atoms: 42
TPSA: 144.69 NumAromaticRings: 0

Sugarmoiety
SD00005

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