Glycoside
...
GD032351

Name:
None

Formula:
C48H75O16N

Smiles:
CCOC(=O)c1ccc(OCC[C@@H]2C[C@H](C)C(=O)C=CC(C)=C[C@H](CO[C@@H]3O[C@H](C)[C@H](O)[C@H](OC)[C@H]3OC)[C@H](CC)OC(=O)C[C@H](O)[C@H](C)[C@H]2O[C@@H]2O[C@H](C)[C@H](O)[C@H](N(C)C)[C@H]2O)cc1

Aglycone:
CCOC(=O)c1ccc(OCCC2CC(C)C(=O)C=CC(C)=CC(CO)C(CC)OC(=O)CC(O)C(C)C2O)cc1

Sugarmoiety:
CC1OC(O)C(O)C(N(C)C)C1O.COC1C(O)OC(C)C(O)C1OC

Other Identifiers

Properties
HBA: 17 RingCount: 4
HBD: 4 FractionCSP3: 0.73
AlogP: 3.62 Num_rotatable_bonds: 15
MolWt: 922.12 Num_heavy_atoms: 65
TPSA: 218.44 NumAromaticRings: 1

Unique Aglycone
AD20756
Formula: C32H46O9

Smiles:
CCOC(=O)c1ccc(OCCC2CC(C)C(=O)C=CC(C)=CC(CO)C(CC)OC(=O)CC(O)C(C)C2O)cc1
HBA: 9 RingCount: 2
HBD: 3 FractionCSP3: 0.59
AlogP: 4.04 Num_rotatable_bonds: 8
MolWt: 574.71 Num_heavy_atoms: 41
TPSA: 139.59 NumAromaticRings: 1

Sugarmoiety
SD00044

CC1OC(O)C(O)C(N(C)C)C1O.COC1C(O)OC(C)C(O)C1OC