Glycoside
GD017743
Name:
KARAVILOSIDE IFormula:
C38H64O8Smiles:
CO[C@H](C=C(C)C)C[C@H](C)[C@@H]1CC[C@]2(C)[C@@H]3[C@H](OC)C=C4[C@H](CC[C@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)C4(C)C)[C@@]3(C)CC[C@]12CAglycone:
COC(C=C(C)C)CC(C)C1CCC2(C)C3C(OC)C=C4C(CCC(O)C4(C)C)C3(C)CCC12CSugarmoiety:
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
AD12630
Formula: C32H54O3
Smiles:
COC(C=C(C)C)CC(C)C1CCC2(C)C3C(OC)C=C4C(CCC(O)C4(C)C)C3(C)CCC12C| 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 |
