Glycoside
GD129923
Name:
N-(2-{[3,5-dihydroxy-2-(hydroxymethyl)-6-[(1,2,4,5-tetrahydroxy-6-oxohexan-3-yl)oxy]oxan-4-yl]oxy}-5-{[4-({3-acetamido-5-[(4-{[3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-4-hydroxy-6-(hydroxymethyl)oxan-2-yl}oxy)-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-hydroxy-6-(hydroxymethyl)oxan-3-yl)acetamideFormula:
C54H91O41N3Smiles:
CC(O)=NC1C(OC2C(O)C(CO)OC(OC(C(O)CO)C(O)C(O)C=O)C2O)OC(CO)C(OC2OC(CO)C(O)C(OC3OC(CO)C(OC4OC(CO)C(O)C(OC5OC(CO)C(O)C(OC6OC(CO)C(O)C(O)C6O)C5N=C(C)O)C4O)C(O)C3N=C(C)O)C2O)C1OAglycone:
[empty]Sugarmoiety:
CC(O)=NC1C(OC2C(O)C(CO)OC(OC(C(O)CO)C(O)C(O)C=O)C2O)OC(CO)C(OC2OC(CO)C(O)C(OC3OC(CO)C(OC4OC(CO)C(O)C(OC5OC(CO)C(O)C(OC6OC(CO)C(O)C(O)C6O)C5N=C(C)O)C4O)C(O)C3N=C(C)O)C2O)C1OOther Identifiers
Properties
| HBA: | 44 | RingCount: | 7 |
| HBD: | 26 | FractionCSP3: | 0.93 |
| AlogP: | -15.66 | Num_rotatable_bonds: | 29 |
| MolWt: | 1438.3 | Num_heavy_atoms: | 98 |
| TPSA: | 709.35 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD07157
CC(O)=NC1C(OC2C(O)C(CO)OC(OC(C(O)CO)C(O)C(O)C=O)C2O)OC(CO)C(OC2OC(CO)C(O)C(OC3OC(CO)C(OC4OC(CO)C(O)C(OC5OC(CO)C(O)C(OC6OC(CO)C(O)C(O)C6O)C5N=C(C)O)C4O)C(O)C3N=C(C)O)C2O)C1O