Glycoside
GD146896
Name:
4-({3-[(3,5-dihydroxy-6-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-4,5-dihydroxy-6-methyloxan-2-yl}oxy)-2-{[3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-5-hydroxy-6-methyloxan-3-yl acetateFormula:
C34H57O24NSmiles:
CC(=O)OC1C(OC2C(O)C(CO)OC(O)C2N=C(C)O)OC(C)C(O)C1OC1OC(C)C(O)C(O)C1OC1OC(C)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1OAglycone:
[empty]Sugarmoiety:
CC(=O)OC1C(OC2C(O)C(CO)OC(O)C2N=C(C)O)OC(C)C(O)C1OC1OC(C)C(O)C(O)C1OC1OC(C)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 25 | RingCount: | 5 |
| HBD: | 13 | FractionCSP3: | 0.94 |
| AlogP: | -7.29 | Num_rotatable_bonds: | 12 |
| MolWt: | 863.81 | Num_heavy_atoms: | 59 |
| TPSA: | 384.72 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD09389
CC(=O)OC1C(OC2C(O)C(CO)OC(O)C2N=C(C)O)OC(C)C(O)C1OC1OC(C)C(O)C(O)C1OC1OC(C)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1O