Glycoside
GD158262
Name:
(17Rs)-17-(Beta-D-Glucopyranosyloxy)AntidesmoneFormula:
C25H39O9NSmiles:
COc1c(C)[nH]c2c(c1=O)C(CCCCCCC(C)OC1OC(CO)C(O)C(O)C1O)CCC2=OAglycone:
COc1c(C)[nH]c2c(c1=O)C(CCCCCCC(C)O)CCC2=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.76 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 11 |
| MolWt: | 497.59 | Num_heavy_atoms: | 35 |
| TPSA: | 158.54 | NumAromaticRings: | 1 |
Unique Aglycone
AD62489
Formula: C19H29O4N
Smiles:
COc1c(C)[nH]c2c(c1=O)C(CCCCCCC(C)O)CCC2=O| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.68 |
| AlogP: | 3.47 | Num_rotatable_bonds: | 8 |
| MolWt: | 335.44 | Num_heavy_atoms: | 24 |
| TPSA: | 79.39 | NumAromaticRings: | 1 |
