Glycoside
GD124876
Name:
6-({10,14-dimethyl-17,20,21-trioxahexacyclo[14.4.1.0¹,¹â´.0²,¹¹.0âµ,¹â°.0¹âµ,¹â¹]henicos-4-en-7-yl}oxy)-4-methoxy-2-methyloxan-3-olFormula:
C27H40O7Smiles:
COC1CC(OC2CCC3(C)C(=CCC4C3CCC3(C)C5C6COC5OC43O6)C2)OC(C)C1OAglycone:
CC12CCC(O)CC1=CCC1C2CCC2(C)C3C4COC3OC12O4Sugarmoiety:
COC1CC(O)OC(C)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 7 |
| HBD: | 1 | FractionCSP3: | 0.93 |
| AlogP: | 3.53 | Num_rotatable_bonds: | 3 |
| MolWt: | 476.61 | Num_heavy_atoms: | 34 |
| TPSA: | 75.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD50479
Formula: C20H28O4
Smiles:
CC12CCC(O)CC1=CCC1C2CCC2(C)C3C4COC3OC12O4| HBA: | 4 | RingCount: | 6 |
| HBD: | 1 | FractionCSP3: | 0.9 |
| AlogP: | 3.0 | Num_rotatable_bonds: | 0 |
| MolWt: | 332.44 | Num_heavy_atoms: | 24 |
| TPSA: | 47.92 | NumAromaticRings: | 0 |
