| Phytochemical Name : Heptadecanoic acid |
| PCNDIDH0014 |
| Pubchem CID : 10465 |
| Molecular formula: C17H34O2 |
| Canonical SMILES : CCCCCCCCCCCCCCCCC(=O)O |
Synonymes : HEPTADECANOIC ACID|Margaric acid|506-12-7|n-Heptadecanoic acid|Margarinic acid|n-Heptadecylic acid|n-Heptadecoic acid|Heptadecylic acid|NSC 3743|C17:0|Normal-heptadecanoic acid|EINECS 208-027-1|MFCD00002751|BRN 1781004|UNII-V987Y9OZ8L|AI3-36481|V987Y9OZ8L|CHEBI:32365|HEPTADECANOIC-D33 ACID|margarinate|margaroate|NSC-3743|EINECS 270-298-7|n-heptadecoate|n-heptadecylate|68424-37-3|EC 270-298-7|4-02-00-01193 (Beilstein Handbook Reference)|Lead(2+) heptadecanoate|352431-41-5|EINECS 264-123-3|Margarinsaeure|margaric'acid|margaroic acid|Daturinic acid|Daturic acid|heptadecoic acid|Heptadecanoic acic|X90|Normal-heptadecanoate|heptadecansäure|Heptadecanoic acid, 98%|DSSTox_CID_1596|MARGARIC ACID [MI]|SCHEMBL5941|DSSTox_RID_78651|DSSTox_GSID_28306|Heptadecanoic acid, >=98%|WLN: QV16|CH3-[CH2]15-COOH|CHEMBL1172910|DTXSID5021596|FA 17:0a|AMY5932|NSC3743|EINECS 266-928-5|Tox21_202550|BBL013181|LMFA01010017|s3336|STL163960|AKOS005716689|CS-W004284|FA 17:0|HY-W004284|NSC 122836|NCGC00260099-01|AS-57021|BP-27918|BP-30092|LS-74182|SY010570|SDA 19-005-00|CAS-67701-03-5|FT-0628169|H0019|EN300-19173|EC 266-928-5|H10748|A871505|Q902204|8EBAABCC-09B2-43FB-945D-A70E5905BFBE|Z104473032 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 4.110 |
| Log Po/w (XLOGP3) : 7.690 |
| Log Po/w (WLOGP) : 5.940 |
| Log Po/w (MLOGP) : 4.440 |
| Log Po/w (SILICOS-IT) : 5.690 |
| Consensus Log Po/w : 5.570 |