Glycoside
...
GD023818

Name:
None

Formula:
C44H69O14N

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]3[C@H]2OC(=O)N3Cc2ccccc2)[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)CC3C2OC(=O)N3Cc2ccccc2)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: 15 RingCount: 5
HBD: 3 FractionCSP3: 0.8
AlogP: 4.54 Num_rotatable_bonds: 9
MolWt: 836.03 Num_heavy_atoms: 59
TPSA: 188.98 NumAromaticRings: 1

Unique Aglycone
AD15986
Formula: C36H55O11N

Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC3C2OC(=O)N3Cc2ccccc2)C(C)(OC)CC(C)C(=O)C(C)C(O)C1(C)O
HBA: 12 RingCount: 4
HBD: 3 FractionCSP3: 0.75
AlogP: 3.61 Num_rotatable_bonds: 6
MolWt: 677.83 Num_heavy_atoms: 48
TPSA: 161.29 NumAromaticRings: 1

Sugarmoiety
SD00005

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