Glycoside
...
GD017651

Name:
None

Formula:
C44H69O14N

Smiles:
CC[C@@H]1OC(=O)C[C@H](O)[C@H](C)[C@H](O[C@@H]2O[C@H](C)[C@H](O)[C@H](N(C)C)[C@H]2O)[C@H](CCOc2ccccc2)C[C@H](C)C(=O)C=CC(C)=C[C@H]1CO[C@@H]1O[C@H](C)[C@H](O)[C@H](O)[C@H]1OC

Aglycone:
CCC1OC(=O)CC(O)C(C)C(O)C(CCOc2ccccc2)CC(C)C(=O)C=CC(C)=CC1CO

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

Other Identifiers

Properties
HBA: 15 RingCount: 4
HBD: 5 FractionCSP3: 0.73
AlogP: 2.79 Num_rotatable_bonds: 12
MolWt: 836.03 Num_heavy_atoms: 59
TPSA: 203.14 NumAromaticRings: 1

Unique Aglycone
AD00589
Formula: C29H42O7

Smiles:
CCC1OC(=O)CC(O)C(C)C(O)C(CCOc2ccccc2)CC(C)C(=O)C=CC(C)=CC1CO
HBA: 7 RingCount: 2
HBD: 3 FractionCSP3: 0.59
AlogP: 3.86 Num_rotatable_bonds: 6
MolWt: 502.65 Num_heavy_atoms: 36
TPSA: 113.29 NumAromaticRings: 1

Sugarmoiety
SD00753

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