Glycoside
GD149612
Name:
3,6,9a-trimethyl-9-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-dodecahydroazuleno[4,5-b]furan-2-oneFormula:
C21H34O8Smiles:
CC1CCC2C(C)C(=O)OC2C2(C)C(OC3OC(CO)C(O)C(O)C3O)CCC12Aglycone:
CC1CCC2C(C)C(=O)OC2C2(C)C(O)CCC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.95 |
| AlogP: | 0.2 | Num_rotatable_bonds: | 3 |
| MolWt: | 414.5 | Num_heavy_atoms: | 29 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD59812
Formula: C15H24O3
Smiles:
CC1CCC2C(C)C(=O)OC2C2(C)C(O)CCC12| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.93 |
| AlogP: | 2.37 | Num_rotatable_bonds: | 0 |
| MolWt: | 252.35 | Num_heavy_atoms: | 18 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
