|
Structure
|
|
| Relationships |
Total Number of functionally related protein(s) :
1
Total Number of Articles : 1
|
| PubChem |
87583
|
| Molecular Formula |
C17H20O4 |
| SMILES |
CCCCCCC(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)C |
| InChI |
InChI=1S/C17H20O4/c1-3-4-5-6-7-16(18)20-13-8-9-14-12(2)10-17(19)21-15(14)11-13/h8-11H,3-7H2,1-2H3 |
| synonyms |
- 4-Methylumbelliferyl heptanoate
- 18319-92-1
- Heptanoic acid, 4-methyl-2-oxo-2H-1-benzopyran-7-yl ester
- 4-methylumbelliferone heptanoate
- EINECS 242-207-0
- DTXSID1066362
- Heptanoic acid, ester with 7-hydroxy-4-methylcoumarin
- 4-MUH
- DTXCID9035832
- 4-methyl-2-oxo-2h-chromen-7-yl heptanoate
- (4-methyl-2-oxochromen-7-yl) heptanoate
- Heptanoic acid 4-methylumbelliferyl ester
- 4-Methylumbelliferyl enanthate
- MFCD00037611
- 4-methyl-2-oxochromen-7-yl heptanoate
- 4-Methyl-2-oxo-2H-1-benzopyran-7-yl heptanoate
- SCHEMBL381723
- BDBM24568
- CHEBI:231300
- FFNBFZWIBOIPIV-UHFFFAOYSA-N
- AKOS015916460
- EM67746
- 4-methylumbelliferyl heptanoate (4-MUH)
- AS-70498
- DA-60368
- PD194713
- 4-methyl-2-oxo-2h-chromen-7-ylheptanoate
- (4-Methyl-2-oxo-chromen-7-yl) heptanoate
- HY-126938
- CS-0108414
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| Properties |
| Property |
Value |
| MW |
288.34 g/mol |
| HBD |
0 |
| HBA |
4 |
| Rotatable Bond Count |
7 |
| Exact Mass |
288.13615911 g/mol |
| Monoisotopic Mass |
288.13615911 g/mol |
| Heavy Atom Count |
21 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
413 |
| xlogp |
4.5 |
| Topological Polar Surface Area |
52.6 |
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