Glycoside
GD119839
Name:
2-[(1,6-dihydroxytrideca-3,11-dien-7,9-diyn-5-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C19H26O8Smiles:
CC=CC#CC#CC(O)C(C=CCCO)OC1OC(CO)C(O)C(O)C1OAglycone:
CC=CC#CC#CC(O)C(O)C=CCCOSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.58 |
| AlogP: | -1.95 | Num_rotatable_bonds: | 7 |
| MolWt: | 382.41 | Num_heavy_atoms: | 27 |
| TPSA: | 139.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD48073
Formula: C13H16O3
Smiles:
CC=CC#CC#CC(O)C(O)C=CCCO| HBA: | 3 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.38 |
| AlogP: | 0.23 | Num_rotatable_bonds: | 4 |
| MolWt: | 220.27 | Num_heavy_atoms: | 16 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
