Glycoside
GD155363
Name:
N-(2-{[3,5-dihydroxy-2-(hydroxymethyl)-6-[(1,2,4,5-tetrahydroxy-6-oxohexan-3-yl)oxy]oxan-4-yl]oxy}-4-[(4-{[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5-hydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl)oxy]-6-(hydroxymethyl)-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl)acetamideFormula:
C46H78O34N2Smiles:
CC(O)=NC1C(OC2C(O)C(CO)OC(OC3C(N=C(C)O)C(OC4C(O)C(CO)OC(OC(C(O)CO)C(O)C(O)C=O)C4O)OC(CO)C3OC3OC(C)C(O)C(O)C3O)C2OC2OC(C)C(O)C(O)C2O)OC(CO)C(O)C1OAglycone:
[empty]Sugarmoiety:
CC(O)=NC1C(OC2C(O)C(CO)OC(OC3C(N=C(C)O)C(OC4C(O)C(CO)OC(OC(C(O)CO)C(O)C(O)C=O)C4O)OC(CO)C3OC3OC(C)C(O)C(O)C3O)C2OC2OC(C)C(O)C(O)C2O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 36 | RingCount: | 6 |
| HBD: | 21 | FractionCSP3: | 0.93 |
| AlogP: | -12.41 | Num_rotatable_bonds: | 23 |
| MolWt: | 1203.11 | Num_heavy_atoms: | 82 |
| TPSA: | 577.38 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD10339
CC(O)=NC1C(OC2C(O)C(CO)OC(OC3C(N=C(C)O)C(OC4C(O)C(CO)OC(OC(C(O)CO)C(O)C(O)C=O)C4O)OC(CO)C3OC3OC(C)C(O)C(O)C3O)C2OC2OC(C)C(O)C(O)C2O)OC(CO)C(O)C1O