Glycoside
...
GD153022

Name:
Linckoside C

Formula:
C41H70O14

Smiles:
COC1C(OC2C=C3C(O)CC4(O)C(CCC5(C)C(C(C)CCC(C(C)C)C(C)COC6OCC(O)C(O)C6O)C(O)C(O)C54)C3(C)CC2)OCC(O)C1O

Aglycone:
CC(C)C(CCC(C)C1C(O)C(O)C2C1(C)CCC1C3(C)CCC(O)C=C3C(O)CC12O)C(C)CO

Sugarmoiety:
COC1C(O)OCC(O)C1O.OC1COC(O)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 6
HBD: 9 FractionCSP3: 0.95
AlogP: 0.85 Num_rotatable_bonds: 12
MolWt: 787.0 Num_heavy_atoms: 55
TPSA: 228.22 NumAromaticRings: 0

Unique Aglycone
AD60888
Formula: C30H52O6

Smiles:
CC(C)C(CCC(C)C1C(O)C(O)C2C1(C)CCC1C3(C)CCC(O)C=C3C(O)CC12O)C(C)CO
HBA: 6 RingCount: 4
HBD: 6 FractionCSP3: 0.93
AlogP: 3.27 Num_rotatable_bonds: 7
MolWt: 508.74 Num_heavy_atoms: 36
TPSA: 121.38 NumAromaticRings: 0

Sugarmoiety
SD05495

COC1C(O)OCC(O)C1O.OC1COC(O)C(O)C1O