Glycoside
...
GD147412

Name:
{3,4,5-trihydroxy-6-[(31-hydroxy-2,6,10,14,19,23,27,31-octamethyldotriaconta-4,6,8,10,12,14,16,18,20,22,24,26,28-tridecaen-2-yl)oxy]oxan-2-yl}methyl butanoate

Formula:
C50H72O8

Smiles:
CCCC(=O)OCC1OC(OC(C)(C)CC=CC(C)=CC=CC(C)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C=CCC(C)(C)O)C(O)C(O)C1O

Aglycone:
CC(C=CC=C(C)C=CC=C(C)C=CCC(C)(C)O)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C=CCC(C)(C)O.CCCC(=O)OC

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

Other Identifiers

Properties
HBA: 8 RingCount: 1
HBD: 4 FractionCSP3: 0.46
AlogP: 10.05 Num_rotatable_bonds: 22
MolWt: 801.12 Num_heavy_atoms: 58
TPSA: 125.68 NumAromaticRings: 0

Unique Aglycone
AD01168
Formula: C5H10O2

Smiles:
CCCC(=O)OC
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.8
AlogP: 0.96 Num_rotatable_bonds: 2
MolWt: 102.13 Num_heavy_atoms: 7
TPSA: 26.3 NumAromaticRings: 0
AD48271
Formula: C40H56O2

Smiles:
CC(C=CC=C(C)C=CC=C(C)C=CCC(C)(C)O)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C=CCC(C)(C)O
HBA: 2 RingCount: 0
HBD: 2 FractionCSP3: 0.35
AlogP: 10.88 Num_rotatable_bonds: 16
MolWt: 568.89 Num_heavy_atoms: 42
TPSA: 40.46 NumAromaticRings: 0

Sugarmoiety
SD00017

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