Glycoside
...
GD020419

Name:
None

Formula:
C36H50O11N2

Smiles:
CC(=O)O[C@@H]1[C@H](OCC2=C[C@@H]3[C@H](C[C@H](OC(=O)C=Cc4cn(C)cn4)[C@]4(C)C=C[C@@]2(OCCO)O4)C(C)=CC[C@H]3C(C)C)OC[C@H](O)[C@H]1O

Aglycone:
CC1=CCC(C(C)C)C2C=C(CO)C3(OCCO)C=CC(C)(O3)C(OC(=O)C=Cc3cn(C)cn3)CC12

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
AD14098
Formula: C29H40O6N2

Smiles:
CC1=CCC(C(C)C)C2C=C(CO)C3(OCCO)C=CC(C)(O3)C(OC(=O)C=Cc3cn(C)cn3)CC12
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