Glycoside
...
GD129371

Name:
N-{1-[(3-acetamido-5-{[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-(hydroxymethyl)-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl)oxy]-3,4-dihydroxy-16-methylheptadecan-2-yl}-2-hydroxydocosanamide

Formula:
C62H117O19N3

Smiles:
CCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(COC1OC(CO)C(OC2OC(CO)C(O)C(O)C2N=C(C)O)C(OC2OC(C)C(O)C(O)C2O)C1N=C(C)O)C(O)C(O)CCCCCCCCCCCC(C)C

Aglycone:
CCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCCC(C)C

Sugarmoiety:
CC(O)=NC1C(OC2C(CO)OC(O)C(N=C(C)O)C2OC2OC(C)C(O)C(O)C2O)OC(CO)C(O)C1O

Other Identifiers

Properties
HBA: 22 RingCount: 3
HBD: 13 FractionCSP3: 0.95
AlogP: 7.23 Num_rotatable_bonds: 46
MolWt: 1208.62 Num_heavy_atoms: 84
TPSA: 355.45 NumAromaticRings: 0

Unique Aglycone
AD52410
Formula: C40H81O5N

Smiles:
CCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCCC(C)C
HBA: 6 RingCount: 0
HBD: 5 FractionCSP3: 0.97
AlogP: 10.77 Num_rotatable_bonds: 36
MolWt: 656.09 Num_heavy_atoms: 46
TPSA: 113.51 NumAromaticRings: 0

Sugarmoiety
SD05515

CC(O)=NC1C(OC2C(CO)OC(O)C(N=C(C)O)C2OC2OC(C)C(O)C(O)C2O)OC(CO)C(O)C1O