Glycoside
GD128554
Name:
2-({4a,5,7-trihydroxy-7-methyl-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-1-yl}methyl)-3-(acetyloxy)-5-hydroxy-6-(hydroxymethyl)oxan-4-yl acetateFormula:
C20H30O11Smiles:
CC(=O)OC1C(CC2OC=CC3(O)C(O)CC(C)(O)C23)OC(CO)C(O)C1OC(C)=OAglycone:
CC1OC=CC2(O)C(O)CC(C)(O)C12Sugarmoiety:
CC(=O)OC1C(O)OC(CO)C(O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.8 |
| AlogP: | -1.86 | Num_rotatable_bonds: | 5 |
| MolWt: | 446.45 | Num_heavy_atoms: | 31 |
| TPSA: | 172.21 | NumAromaticRings: | 0 |
Unique Aglycone
AD49612
Formula: C10H16O4
Smiles:
CC1OC=CC2(O)C(O)CC(C)(O)C12| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.8 |
| AlogP: | -0.22 | Num_rotatable_bonds: | 0 |
| MolWt: | 200.23 | Num_heavy_atoms: | 14 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
