6-Heneicosen-11-one, (6Z)-
PubChem CID: 5364717
Connections displayed (default: 10).
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| Compound Synonyms | (Z)-6-Heneicosen-11-one, 54844-65-4, (Z)-henicos-6-en-11-one, 6-Heneicosen-11-one, (Z)-, (6Z)-Heneicosen-11-one, 6-Heneicosen-11-one, (6Z)-, (Z)-6-Henicosen-11-one, (Z)-6-Heneicosane-11-one, 6Z-Heneicosen-11-one, 76H4B905AX, Z-6-Heneicosen-11-one, cis-6-heneicosene-11-one, (6Z)-HENEICOS-6-EN-11-ONE, HENEICOSANE-11-ONE, (Z)-6-, UNII-76H4B905AX, SCHEMBL592119, (6Z)-6-heneicosen-11-one, (6Z)-henicos-6-en-11-one, DTXSID70886116, (6Z)-6-Henicosen-11-one #, LMFA12000214, HY-W679971, CS-0763839, Z-6-Heneicosen-11-one CAS 54844-65-4, Q27266492 |
|---|---|
| Topological Polar Surface Area | 17.1 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 22.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 255.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (Z)-henicos-6-en-11-one |
| Prediction Hob | 0.0 |
| Xlogp | 8.3 |
| Molecular Formula | C21H40O |
| Prediction Swissadme | 0.0 |
| Inchi Key | YLNMHCDVFVPONQ-QBFSEMIESA-N |
| Fcsp3 | 0.8571428571428571 |
| Logs | -4.043 |
| Rotatable Bond Count | 17.0 |
| Logd | 5.008 |
| Compound Name | 6-Heneicosen-11-one, (6Z)- |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 308.308 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 308.308 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 308.5 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 1.0 |
| Esol | -5.82851 |
| Inchi | InChI=1S/C21H40O/c1-3-5-7-9-11-13-15-17-19-21(22)20-18-16-14-12-10-8-6-4-2/h11,13H,3-10,12,14-20H2,1-2H3/b13-11- |
| Smiles | CCCCCCCCCCC(=O)CCC/C=C\CCCCC |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 1.0 |
- 1. Outgoing r'ship
FOUND_INto/from Anodendron Affine (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Cedrela Salvadorensis (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Garcinia Cambogia (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Hertia Cheirifolia (Plant) Rel Props:Source_db:cmaup_ingredients - 5. Outgoing r'ship
FOUND_INto/from Licaria Chrysophylla (Plant) Rel Props:Source_db:cmaup_ingredients - 6. Outgoing r'ship
FOUND_INto/from Ormosia Hosiei (Plant) Rel Props:Source_db:cmaup_ingredients - 7. Outgoing r'ship
FOUND_INto/from Ornithoglossum Viride (Plant) Rel Props:Source_db:cmaup_ingredients - 8. Outgoing r'ship
FOUND_INto/from Petasites Laevigatus (Plant) Rel Props:Source_db:cmaup_ingredients - 9. Outgoing r'ship
FOUND_INto/from Rubia Tetragona (Plant) Rel Props:Source_db:cmaup_ingredients - 10. Outgoing r'ship
FOUND_INto/from Schizanthus Tricolor (Plant) Rel Props:Source_db:cmaup_ingredients - 11. Outgoing r'ship
FOUND_INto/from Sphaeranthus Confertifolius (Plant) Rel Props:Source_db:cmaup_ingredients