Glycoside
...
GD155299

Name:
Beta-Glccer

Formula:
C46H89O8N

Smiles:
CCCCCCCCCCCCCC=CC(O)C(COC1OC(CO)C(O)C(O)C1O)N=C(O)CCCCCCCCCCCCCCCCCCCCC

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

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 1
HBD: 6 FractionCSP3: 0.93
AlogP: 10.57 Num_rotatable_bonds: 39
MolWt: 784.22 Num_heavy_atoms: 55
TPSA: 152.2 NumAromaticRings: 0

Unique Aglycone
AD44905
Formula: C40H79O3N

Smiles:
CCCCCCCCCCCCCC=CC(O)C(CO)N=C(O)CCCCCCCCCCCCCCCCCCCCC
HBA: 4 RingCount: 0
HBD: 3 FractionCSP3: 0.93
AlogP: 12.74 Num_rotatable_bonds: 36
MolWt: 622.08 Num_heavy_atoms: 44
TPSA: 73.05 NumAromaticRings: 0

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O