Glycoside
GD133229
Name:
3,4,5-tris(acetyloxy)oxan-2-yl 1-[2-(furan-3-yl)ethyl]-1,4a,5-trimethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalene-2-carboxylateFormula:
C31H42O10Smiles:
CC(=O)OC1COC(OC(=O)C2CCC3(C)C(C)=CCCC3C2(C)CCc2ccoc2)C(OC(C)=O)C1OC(C)=OAglycone:
CC1=CCCC2C1(C)CCC(C(=O)O)C2(C)CCc1ccoc1Sugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.68 |
| AlogP: | 4.69 | Num_rotatable_bonds: | 8 |
| MolWt: | 574.67 | Num_heavy_atoms: | 41 |
| TPSA: | 127.57 | NumAromaticRings: | 1 |
Unique Aglycone
AD45304
Formula: C20H28O3
Smiles:
CC1=CCCC2C1(C)CCC(C(=O)O)C2(C)CCc1ccoc1| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.65 |
| AlogP: | 5.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 316.44 | Num_heavy_atoms: | 23 |
| TPSA: | 50.44 | NumAromaticRings: | 1 |
