Glycoside
GD138965
Name:
2-(hydroxymethyl)-6-{[1,4,9-trihydroxy-6-(2-hydroxypropan-2-yl)-12,12-dimethyltricyclo[9.4.0.0³,â¸]pentadeca-3,5,7-trien-5-yl]oxy}oxane-3,4,5-triolFormula:
C26H40O10Smiles:
CC(C)(O)c1cc2c(c(O)c1OC1OC(CO)C(O)C(O)C1O)CC1(O)CCCC(C)(C)C1CC2OAglycone:
CC(C)(O)c1cc2c(c(O)c1O)CC1(O)CCCC(C)(C)C1CC2OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.77 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 4 |
| MolWt: | 512.6 | Num_heavy_atoms: | 36 |
| TPSA: | 180.3 | NumAromaticRings: | 1 |
Unique Aglycone
AD56057
Formula: C20H30O5
Smiles:
CC(C)(O)c1cc2c(c(O)c1O)CC1(O)CCCC(C)(C)C1CC2O| HBA: | 5 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.7 |
| AlogP: | 2.86 | Num_rotatable_bonds: | 1 |
| MolWt: | 350.46 | Num_heavy_atoms: | 25 |
| TPSA: | 101.15 | NumAromaticRings: | 1 |
