Glycoside
...
GD009648

Name:
None

Formula:
C47H81O14N3

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(=O)CNCCNCc3ccccc3)[C@H]2O)[C@@](C)(O)C[C@H](C)[C@H](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(C)C(=O)CNCCNCc3ccccc3)C2O)C(C)(O)CC(C)C(O)C(C)C(O)C1(C)O

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

Other Identifiers

Properties
HBA: 17 RingCount: 4
HBD: 8 FractionCSP3: 0.83
AlogP: 1.85 Num_rotatable_bonds: 14
MolWt: 912.17 Num_heavy_atoms: 64
TPSA: 238.2 NumAromaticRings: 1

Unique Aglycone
AD07547
Formula: C39H67O11N3

Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C(=O)CNCCNCc3ccccc3)C2O)C(C)(O)CC(C)C(O)C(C)C(O)C1(C)O
HBA: 14 RingCount: 3
HBD: 8 FractionCSP3: 0.79
AlogP: 0.93 Num_rotatable_bonds: 11
MolWt: 753.98 Num_heavy_atoms: 53
TPSA: 210.51 NumAromaticRings: 1

Sugarmoiety
SD00005

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