Glycoside
GD142567
Name:
4-{3-hydroxy-6-[(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-9,13-dimethyl-17-oxotetracyclo[11.3.1.0¹,¹â°.0â´,â¹]heptadecan-14-yl}-2,5-dihydrofuran-2-oneFormula:
C30H44O8Smiles:
COC1CC(OC2CCC3(C)C(C2)C(O)CC24CCC(C5=CC(=O)OC5)C(C)(CCC23)C4=O)OC(C)C1OAglycone:
CC12CCC3C(CCC1C1=CC(=O)OC1)(CC(O)C1CC(O)CCC13C)C2=OSugarmoiety:
COC1CC(O)OC(C)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 6 |
| HBD: | 2 | FractionCSP3: | 0.87 |
| AlogP: | 3.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 532.67 | Num_heavy_atoms: | 38 |
| TPSA: | 111.52 | NumAromaticRings: | 0 |
Unique Aglycone
AD57368
Formula: C23H32O5
Smiles:
CC12CCC3C(CCC1C1=CC(=O)OC1)(CC(O)C1CC(O)CCC13C)C2=O| HBA: | 5 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.83 |
| AlogP: | 2.78 | Num_rotatable_bonds: | 1 |
| MolWt: | 388.5 | Num_heavy_atoms: | 28 |
| TPSA: | 83.83 | NumAromaticRings: | 0 |
