Glycoside
GD146831
Name:
6-{[4,10-dimethyl-7-(propan-2-yl)tricyclo[4.4.0.0¹,âµ]decan-4-yl]oxy}-4,5-dihydroxy-2-methyloxan-3-yl 2-methylbut-2-enoateFormula:
C26H42O6Smiles:
CC=C(C)C(=O)OC1C(C)OC(OC2(C)CCC34C(C)CCC(C(C)C)C3C24)C(O)C1OAglycone:
CC(C)C1CCC(C)C23CCC(C)(O)C2C13.CC=C(C)C(=O)OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.88 |
| AlogP: | 3.83 | Num_rotatable_bonds: | 5 |
| MolWt: | 450.62 | Num_heavy_atoms: | 32 |
| TPSA: | 85.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD00342
Formula: C5H8O2
Smiles:
CC=C(C)C(=O)O| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.4 |
| AlogP: | 1.04 | Num_rotatable_bonds: | 1 |
| MolWt: | 100.12 | Num_heavy_atoms: | 7 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
AD10223
Formula: C15H26O
Smiles:
CC(C)C1CCC(C)C23CCC(C)(O)C2C13| HBA: | 1 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 3.47 | Num_rotatable_bonds: | 1 |
| MolWt: | 222.37 | Num_heavy_atoms: | 16 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
