Glycoside
GD037547
Name:
NoneFormula:
C37H60O9Smiles:
COC(=O)[C@@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@]4(C)CC[C@@H]5O[C@H]([C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)OC[C@@]5(C)[C@H]4CC[C@@]3(C)[C@@]1(C)CC2Aglycone:
COC(=O)C12CCC(C)(C)CC1C1=CCC3C4(C)CCC5OCOCC5(C)C4CCC3(C)C1(C)CC2Sugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.92 |
| AlogP: | 4.12 | Num_rotatable_bonds: | 6 |
| MolWt: | 648.88 | Num_heavy_atoms: | 46 |
| TPSA: | 145.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD23637
Formula: C32H50O4
Smiles:
COC(=O)C12CCC(C)(C)CC1C1=CCC3C4(C)CCC5OCOCC5(C)C4CCC3(C)C1(C)CC2| HBA: | 4 | RingCount: | 6 |
| HBD: | 0 | FractionCSP3: | 0.91 |
| AlogP: | 7.31 | Num_rotatable_bonds: | 1 |
| MolWt: | 498.75 | Num_heavy_atoms: | 36 |
| TPSA: | 44.76 | NumAromaticRings: | 0 |
