| Phytochemical Name : Ambrettolide |
| PCNDIDA0114 |
| Pubchem CID : 5365703 |
| Molecular formula: C16H28O2 |
| Canonical SMILES : C1CCCCOC(=O)CCCCCC=CCCC1 |
Synonymes : Ambrettolide|Ambrettolid|123-69-3|Musk natural|Natural musk ambrette|(8Z)-1-oxacycloheptadec-8-en-2-one|Musk|Oxacycloheptadec-8-en-2-one|Oxacycloheptadec-8-en-2-one, (8Z)-|omega-6-Hexadecenlactone|(Z)-Oxacycloheptadec-8-en-2-one|Musk ambrette (natural)|Hexadec-7-en-16-olide|16-Hydroxy-7-hexadecenoic acid lactone|OXACYCLOHEPTADEC-8-EN-2-ONE, (Z)-|(Z)-7-Hexadecen-1,16-olide|Musk ambrette, natural|EINECS 204-644-5|(Z)-7-Hexadecen-16-olide|AI3-30957|UNII-095I377U8F|(8Z)-Oxacycloheptadec-8-en-2-one|095I377U8F|MUSK TONKIN|7-Hexadecen-16-olid|MUSK [WHO-DD]|SCHEMBL1539181|CHEMBL3727440|8Z-oxacycloheptadec-8-en-2-one|FEMA 2758|DTXSID20881237|CHEBI:189999|HEXADEC-7(Z)-EN-16-OLIDE|hexadec - 7 - en - 16 - olide|AKOS015914244|7-HEXADECEN-16-OLIDE, (Z)-|NCGC00178599-01|LS-98808|16-Hydroxy-7-hexadecenoic acid lactone, cis-|Q4064043 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.350 |
| Log Po/w (XLOGP3) : 5.520 |
| Log Po/w (WLOGP) : 4.780 |
| Log Po/w (MLOGP) : 3.690 |
| Log Po/w (SILICOS-IT) : 3.750 |
| Consensus Log Po/w : 4.220 |