Glycoside
GD154926
Name:
Karaviloside IFormula:
C38H64O8Smiles:
COC1C=C2C(CCC(OC3OC(CO)C(O)C(O)C3O)C2(C)C)C2(C)CCC3(C)C(C(C)CC=CC(C)(C)OC)CCC3(C)C12Aglycone:
COC1C=C2C(CCC(O)C2(C)C)C2(C)CCC3(C)C(C(C)CC=CC(C)(C)OC)CCC3(C)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.89 |
| AlogP: | 5.41 | Num_rotatable_bonds: | 9 |
| MolWt: | 648.92 | Num_heavy_atoms: | 46 |
| TPSA: | 117.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD61490
Formula: C32H54O3
Smiles:
COC1C=C2C(CCC(O)C2(C)C)C2(C)CCC3(C)C(C(C)CC=CC(C)(C)OC)CCC3(C)C12| HBA: | 3 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.88 |
| AlogP: | 7.58 | Num_rotatable_bonds: | 6 |
| MolWt: | 486.78 | Num_heavy_atoms: | 35 |
| TPSA: | 38.69 | NumAromaticRings: | 0 |
