Glycoside
GD117042
Name:
2-(hydroxymethyl)-6-{5,7',13'-trimethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,â¹.0â´,â¸.0¹³,¹â¸]icosane]-3,16'-dioloxy}oxane-3,4,5-triolFormula:
C32H52O10Smiles:
CC1COC2(OC3CC4C(CCC5C4CCC4CC(O)CCC45C)C3C2C)C(O)C1OC1OC(CO)C(O)C(O)C1OAglycone:
CC1COC2(OC3CC4C(CCC5C4CCC4CC(O)CCC45C)C3C2C)C(O)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 7 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 3 |
| MolWt: | 596.76 | Num_heavy_atoms: | 42 |
| TPSA: | 158.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD46597
Formula: C26H42O5
Smiles:
CC1COC2(OC3CC4C(CCC5C4CCC4CC(O)CCC45C)C3C2C)C(O)C1O| HBA: | 5 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 3.35 | Num_rotatable_bonds: | 0 |
| MolWt: | 434.62 | Num_heavy_atoms: | 31 |
| TPSA: | 79.15 | NumAromaticRings: | 0 |
