Glycoside
GD147820
Name:
N-(5-{[3-acetamido-5-({4-[(3-{[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-5-hydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl}oxy)-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-hydroxy-6-(hydroxymethyl)-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl)acetamideFormula:
C53H89O39N3Smiles:
CC(O)=NC1C(OC2C(OC3C(O)C(COC4OC(CO)C(O)C(O)C4O)OC(OC4C(CO)OC(OC5C(CO)OC(O)C(N=C(C)O)C5OC5OC(C)C(O)C(O)C5O)C(N=C(C)O)C4O)C3OC3OCC(O)C(O)C3O)OC(CO)C(O)C2O)OC(CO)C(O)C1OAglycone:
[empty]Sugarmoiety:
CC(O)=NC1C(OC2C(OC3C(O)C(COC4OC(CO)C(O)C(O)C4O)OC(OC4C(CO)OC(OC5C(CO)OC(O)C(N=C(C)O)C5OC5OC(C)C(O)C(O)C5O)C(N=C(C)O)C4O)C3OC3OCC(O)C(O)C3O)OC(CO)C(O)C2O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 42 | RingCount: | 8 |
| HBD: | 24 | FractionCSP3: | 0.94 |
| AlogP: | -13.83 | Num_rotatable_bonds: | 23 |
| MolWt: | 1392.28 | Num_heavy_atoms: | 95 |
| TPSA: | 661.05 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD09492
CC(O)=NC1C(OC2C(OC3C(O)C(COC4OC(CO)C(O)C(O)C4O)OC(OC4C(CO)OC(OC5C(CO)OC(O)C(N=C(C)O)C5OC5OC(C)C(O)C(O)C5O)C(N=C(C)O)C4O)C3OC3OCC(O)C(O)C3O)OC(CO)C(O)C2O)OC(CO)C(O)C1O