Glycoside
...
GD029366

Name:
None

Formula:
C51H90O10

Smiles:
CCCCCCCCC=CCCCCCCCCOC[C@@H]1O[C@H](O[C@@H]2OC=C[C@@H]3[C@H](O)[C@@H]4O[C@@]4(COCCCCCCCCC=CCCCCCCCC)[C@H]23)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
CCCCCCCCC=CCCCCCCCCOC.CCCCCCCCC=CCCCCCCCCOCC12OC1C(O)C1C=COC(O)C12

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

Other Identifiers

Properties
HBA: 10 RingCount: 4
HBD: 4 FractionCSP3: 0.88
AlogP: 10.53 Num_rotatable_bonds: 38
MolWt: 863.27 Num_heavy_atoms: 61
TPSA: 139.6 NumAromaticRings: 0

Unique Aglycone
AD19104
Formula: C19H38O

Smiles:
CCCCCCCCC=CCCCCCCCCOC
HBA: 1 RingCount: 0
HBD: 0 FractionCSP3: 0.89
AlogP: 6.67 Num_rotatable_bonds: 16
MolWt: 282.51 Num_heavy_atoms: 20
TPSA: 9.23 NumAromaticRings: 0
AD19105
Formula: C27H46O5

Smiles:
CCCCCCCCC=CCCCCCCCCOCC12OC1C(O)C1C=COC(O)C12
HBA: 5 RingCount: 3
HBD: 2 FractionCSP3: 0.85
AlogP: 5.65 Num_rotatable_bonds: 18
MolWt: 450.66 Num_heavy_atoms: 32
TPSA: 71.45 NumAromaticRings: 0

Sugarmoiety
SD00017

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