Glycoside
GD138764
Name:
4,5-dihydroxy-2-({15-hydroxy-5,5-dimethyl-14-methylidenetetracyclo[11.2.1.0¹,¹â°.0â´,â¹]hexadecan-9-yl}methoxy)-6-(hydroxymethyl)oxan-3-yl acetateFormula:
C28H44O8Smiles:
C=C1C2CCC3C(CCC4C(C)(C)CCCC43COC3OC(CO)C(O)C(O)C3OC(C)=O)(C2)C1OAglycone:
C=C1C2CCC3C(CCC4C(C)(C)CCCC43CO)(C2)C1OSugarmoiety:
CC(=O)OC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.89 |
| AlogP: | 2.31 | Num_rotatable_bonds: | 5 |
| MolWt: | 508.65 | Num_heavy_atoms: | 36 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD55984
Formula: C20H32O2
Smiles:
C=C1C2CCC3C(CCC4C(C)(C)CCCC43CO)(C2)C1O| HBA: | 2 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.9 |
| AlogP: | 3.92 | Num_rotatable_bonds: | 1 |
| MolWt: | 304.47 | Num_heavy_atoms: | 22 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
