Glycoside
GD028470
Name:
NoneFormula:
C29H42O8Smiles:
C[C@@H]1O[C@H](O[C@@H]2CC[C@@]34CO[C@]5(CC[C@H]3C2)[C@H]4CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@@H]52)[C@H](O)[C@H](O)[C@H]1OAglycone:
CC12CCC3C45CCC(O)CC4CCC3(OC5)C1CCC2C1=CC(=O)OC1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 7 |
| HBD: | 3 | FractionCSP3: | 0.9 |
| AlogP: | 2.47 | Num_rotatable_bonds: | 3 |
| MolWt: | 518.65 | Num_heavy_atoms: | 37 |
| TPSA: | 114.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD18590
Formula: C23H32O4
Smiles:
CC12CCC3C45CCC(O)CC4CCC3(OC5)C1CCC2C1=CC(=O)OC1| HBA: | 4 | RingCount: | 6 |
| HBD: | 1 | FractionCSP3: | 0.87 |
| AlogP: | 3.62 | Num_rotatable_bonds: | 1 |
| MolWt: | 372.51 | Num_heavy_atoms: | 27 |
| TPSA: | 55.76 | NumAromaticRings: | 0 |
