Glycoside
...
GD028079

Name:
None

Formula:
C47H69O15N

Smiles:
C[C@H]1CC[C@@]2(OC1)OC1CC3C4CC[C@@H]5C[C@H](O[C@@H]6O[C@H](CO)[C@H](O[C@@H]7O[C@H](COC(=O)NCc8ccccc8)[C@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)CC[C@@]5(C)C4C(=O)C[C@@]3(C)C1[C@H]2C

Aglycone:
CC1CCC2(OC1)OC1CC3C4CCC5CC(O)CCC5(C)C4C(=O)CC3(C)C1C2C.COC(=O)NCc1ccccc1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 16 RingCount: 9
HBD: 7 FractionCSP3: 0.83
AlogP: 2.56 Num_rotatable_bonds: 9
MolWt: 888.06 Num_heavy_atoms: 63
TPSA: 232.16 NumAromaticRings: 1

Unique Aglycone
AD00054
Formula: C9H11O2N

Smiles:
COC(=O)NCc1ccccc1
HBA: 3 RingCount: 1
HBD: 1 FractionCSP3: 0.22
AlogP: 1.54 Num_rotatable_bonds: 2
MolWt: 165.19 Num_heavy_atoms: 12
TPSA: 38.33 NumAromaticRings: 1
AD01997
Formula: C27H42O4

Smiles:
CC1CCC2(OC1)OC1CC3C4CCC5CC(O)CCC5(C)C4C(=O)CC3(C)C1C2C
HBA: 4 RingCount: 6
HBD: 1 FractionCSP3: 0.96
AlogP: 4.97 Num_rotatable_bonds: 0
MolWt: 430.63 Num_heavy_atoms: 31
TPSA: 55.76 NumAromaticRings: 0

Sugarmoiety
SD00326

OCC1OC(O)C(O)C(O)C1OC1OC(O)C(O)C(O)C1O