Glycoside
...
GD010116

Name:
None

Formula:
C35H51O10N

Smiles:
CC=CC=C[C@@H]1O[C@](O)([C@H](C)C(=O)NCC=CC=C(C)C(O)C(C)C2CC(O)C(C=CC=CC=CC(=O)O)O2)[C@H](O)[C@H](O)C1(C)C

Aglycone:
C=CC=CC.CCC(=O)NCC=CC=C(C)C(O)C(C)C1CC(O)C(C=CC=CC=CC(=O)O)O1

Sugarmoiety:
CC1(C)C(O)OC(O)(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 2
HBD: 7 FractionCSP3: 0.54
AlogP: 2.48 Num_rotatable_bonds: 14
MolWt: 645.79 Num_heavy_atoms: 46
TPSA: 186.01 NumAromaticRings: 0

Unique Aglycone
AD00163
Formula: C5H8

Smiles:
C=CC=CC
HBA: 0 RingCount: 0
HBD: 0 FractionCSP3: 0.2
AlogP: 1.75 Num_rotatable_bonds: 1
MolWt: 68.12 Num_heavy_atoms: 5
TPSA: 0.0 NumAromaticRings: 0
AD07856
Formula: C23H33O6N

Smiles:
CCC(=O)NCC=CC=C(C)C(O)C(C)C1CC(O)C(C=CC=CC=CC(=O)O)O1
HBA: 7 RingCount: 1
HBD: 4 FractionCSP3: 0.48
AlogP: 2.28 Num_rotatable_bonds: 11
MolWt: 419.52 Num_heavy_atoms: 30
TPSA: 116.09 NumAromaticRings: 0

Sugarmoiety
SD01314

CC1(C)C(O)OC(O)(O)C(O)C1O