Glycoside
GD019294
Name:
NoneFormula:
C25H40O7Smiles:
CC1(C)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)CC[C@]2(C)[C@@H]3CC[C@](C)(C=O)C=C3CC[C@@H]12Aglycone:
CC1(C=O)C=C2CCC3C(C)(C)C(O)CCC3(C)C2CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.88 |
| AlogP: | 1.95 | Num_rotatable_bonds: | 4 |
| MolWt: | 452.59 | Num_heavy_atoms: | 32 |
| TPSA: | 116.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD13491
Formula: C19H30O2
Smiles:
CC1(C=O)C=C2CCC3C(C)(C)C(O)CCC3(C)C2CC1| HBA: | 2 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.84 |
| AlogP: | 4.13 | Num_rotatable_bonds: | 1 |
| MolWt: | 290.45 | Num_heavy_atoms: | 21 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
