Glycoside
GD027791
Name:
1,4,9-trimethyl-14-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6,13-dioxatricyclo[8.4.0.0³,â·]tetradecan-5-oneFormula:
C21H34O9Smiles:
CC1CC2OC(=O)C(C)C2CC2(C)C(OC3OC(CO)C(O)C(O)C3O)OCCC12Aglycone:
CC1CC2OC(=O)C(C)C2CC2(C)C(O)OCCC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.95 |
| AlogP: | -0.22 | Num_rotatable_bonds: | 3 |
| MolWt: | 430.49 | Num_heavy_atoms: | 30 |
| TPSA: | 134.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD18229
Formula: C15H24O4
Smiles:
CC1CC2OC(=O)C(C)C2CC2(C)C(O)OCCC12| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.93 |
| AlogP: | 1.96 | Num_rotatable_bonds: | 0 |
| MolWt: | 268.35 | Num_heavy_atoms: | 19 |
| TPSA: | 55.76 | NumAromaticRings: | 0 |
