Glycoside
GD014440
Name:
NoneFormula:
C26H42O8Smiles:
C[C@@]12CCC[C@@](C)(C(=O)O)C1CC[C@@]13C[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@](C)(CCC21)C3Aglycone:
CC12CCC3C(CCC4C(C)(C(=O)O)CCCC34C)(CC1O)C2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.96 |
| AlogP: | 2.06 | Num_rotatable_bonds: | 4 |
| MolWt: | 482.61 | Num_heavy_atoms: | 34 |
| TPSA: | 136.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD10618
Formula: C20H32O3
Smiles:
CC12CCC3C(CCC4C(C)(C(=O)O)CCCC34C)(CC1O)C2| HBA: | 3 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.95 |
| AlogP: | 4.23 | Num_rotatable_bonds: | 1 |
| MolWt: | 320.47 | Num_heavy_atoms: | 23 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
