Glycoside
GD156563
Name:
Mimengoside FFormula:
C47H76O17Smiles:
CC1OC(OC2CCC3(C)C4=CC=C5C6CC(C)(C)CCC6(CO)C(O)CC5(C)C4(C)CCC3C2(C)CO)C(O)C(O)C1OC1OC(CO)C(OC2OCC(O)C(O)C2O)C(O)C1OAglycone:
CC1(C)CCC2(CO)C(O)CC3(C)C(=CC=C4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OC1OC(CO)C(OC2OCC(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 8 |
| HBD: | 11 | FractionCSP3: | 0.91 |
| AlogP: | 0.14 | Num_rotatable_bonds: | 9 |
| MolWt: | 913.11 | Num_heavy_atoms: | 64 |
| TPSA: | 277.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD06950
Formula: C30H48O4
Smiles:
CC1(C)CCC2(CO)C(O)CC3(C)C(=CC=C4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1| HBA: | 4 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.87 |
| AlogP: | 5.0 | Num_rotatable_bonds: | 2 |
| MolWt: | 472.71 | Num_heavy_atoms: | 34 |
| TPSA: | 80.92 | NumAromaticRings: | 0 |
