Glycoside
...
GD032138

Name:
None

Formula:
C36H50O11N2

Smiles:
CCO[C@@]12C=C[C@](C)(O1)[C@H](OC(=O)C=Cc1cn(C)cn1)C[C@@H]1C(CO)=CC[C@H](C(C)C)[C@H]1C=C2CO[C@@H]1OC[C@H](O)[C@H](O)[C@H]1OC(C)=O

Aglycone:
CCOC12C=CC(C)(O1)C(OC(=O)C=Cc1cn(C)cn1)CC1C(CO)=CCC(C(C)C)C1C=C2CO

Sugarmoiety:
CC(=O)OC1C(O)OCC(O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 5
HBD: 3 FractionCSP3: 0.64
AlogP: 2.61 Num_rotatable_bonds: 11
MolWt: 686.8 Num_heavy_atoms: 49
TPSA: 168.03 NumAromaticRings: 1

Unique Aglycone
AD20635
Formula: C29H40O6N2

Smiles:
CCOC12C=CC(C)(O1)C(OC(=O)C=Cc1cn(C)cn1)CC1C(CO)=CCC(C(C)C)C1C=C2CO
HBA: 8 RingCount: 4
HBD: 2 FractionCSP3: 0.59
AlogP: 3.57 Num_rotatable_bonds: 8
MolWt: 512.65 Num_heavy_atoms: 37
TPSA: 103.04 NumAromaticRings: 1

Sugarmoiety
SD00514

CC(=O)OC1C(O)OCC(O)C1O