Glycoside
GD136415
Name:
2-(heptadeca-1,9-dien-11,13-diyn-8-yloxy)-4,5-dihydroxy-6-methyloxan-3-yl acetateFormula:
C25H36O6Smiles:
C=CCCCCCC(C=CC#CC#CCCC)OC1OC(C)C(O)C(O)C1OC(C)=OAglycone:
C=CCCCCCC(O)C=CC#CC#CCCCSugarmoiety:
CC(=O)OC1C(O)OC(C)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.64 |
| AlogP: | 3.27 | Num_rotatable_bonds: | 11 |
| MolWt: | 432.56 | Num_heavy_atoms: | 31 |
| TPSA: | 85.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD45847
Formula: C17H24O
Smiles:
C=CCCCCCC(O)C=CC#CC#CCCC| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.53 |
| AlogP: | 3.85 | Num_rotatable_bonds: | 8 |
| MolWt: | 244.38 | Num_heavy_atoms: | 18 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
