Glycoside
...
GD135288

Name:
Alpha-D-Gal-(1->4)-Beta-D-Gal-(1->4)-Beta-D-Glc-(1<->1')-Cer(D18:1/24:0)

Formula:
C60H113O18N

Smiles:
CCCCCCCCCCCCCC=CC(O)C(COC1OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C1O)N=C(O)CCCCCCCCCCCCCCCCCCCCCCC

Aglycone:
CCCCCCCCCCCCCC=CC(O)C(CO)N=C(O)CCCCCCCCCCCCCCCCCCCCCCC

Sugarmoiety:
OCC1OC(OC2C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 19 RingCount: 3
HBD: 12 FractionCSP3: 0.95
AlogP: 7.0 Num_rotatable_bonds: 47
MolWt: 1136.55 Num_heavy_atoms: 79
TPSA: 310.5 NumAromaticRings: 0

Unique Aglycone
AD46411
Formula: C42H83O3N

Smiles:
CCCCCCCCCCCCCC=CC(O)C(CO)N=C(O)CCCCCCCCCCCCCCCCCCCCCCC
HBA: 4 RingCount: 0
HBD: 3 FractionCSP3: 0.93
AlogP: 13.52 Num_rotatable_bonds: 38
MolWt: 650.13 Num_heavy_atoms: 46
TPSA: 73.05 NumAromaticRings: 0

Sugarmoiety
SD00317

OCC1OC(OC2C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O