Glycoside
...
GD152178

Name:
Longiside A

Formula:
C40H68O7

Smiles:
CCC(C)C(=O)OCC1OC(OC2CCC3(C)C(=CCC4C3CCC3(C)C(C(C)CCC(CC)C(C)C)CCC43)C2)C(O)C(O)C1O

Aglycone:
CCC(C)C(=O)OC.CCC(CCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C)C(C)C

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 7 RingCount: 5
HBD: 3 FractionCSP3: 0.93
AlogP: 7.45 Num_rotatable_bonds: 12
MolWt: 660.98 Num_heavy_atoms: 47
TPSA: 105.45 NumAromaticRings: 0

Unique Aglycone
AD01460
Formula: C29H50O

Smiles:
CCC(CCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C)C(C)C
HBA: 1 RingCount: 4
HBD: 1 FractionCSP3: 0.93
AlogP: 8.02 Num_rotatable_bonds: 6
MolWt: 414.72 Num_heavy_atoms: 30
TPSA: 20.23 NumAromaticRings: 0
AD17547
Formula: C6H12O2

Smiles:
CCC(C)C(=O)OC
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.83
AlogP: 1.21 Num_rotatable_bonds: 2
MolWt: 116.16 Num_heavy_atoms: 8
TPSA: 26.3 NumAromaticRings: 0

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O