Glycoside
GD130743
Name:
6-[(1,6-dihydroxy-1,4-dipropyl-1,2,3,3a,4,5,6,8a-octahydroazulen-4-yl)peroxy]-2-(hydroxymethyl)-2-methyloxane-3,4,5-triolFormula:
C23H40O9Smiles:
CCCC1(O)CCC2C1C=CC(O)CC2(CCC)OOC1OC(C)(CO)C(O)C(O)C1OAglycone:
CCCC1(O)CCC2C1C=CC(O)CC2(CCC)OOSugarmoiety:
CC1(CO)OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.91 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 8 |
| MolWt: | 460.56 | Num_heavy_atoms: | 32 |
| TPSA: | 149.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD52974
Formula: C16H28O4
Smiles:
CCCC1(O)CCC2C1C=CC(O)CC2(CCC)OO| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.88 |
| AlogP: | 2.89 | Num_rotatable_bonds: | 5 |
| MolWt: | 284.4 | Num_heavy_atoms: | 20 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
