1.0 2016-10-03 18:41:26 UTC 2020-05-11 20:42:51 UTC BMDB0060038 BMDB60038 10Z-Heptadecenoic acid 10Z-Heptadecenoic acid, also known as 17:1 N-7 cis or cis-tetradec-10-enoic acid, belongs to the class of organic compounds known as long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms. 10Z-Heptadecenoic acid is a very hydrophobic molecule, practically insoluble (in water), and relatively neutral. (10Z)-10-Heptadecenoic acid (10Z)-Heptadec-10-enoic acid 17:1 N-7 cis C17:1 N-7 cis cis-10-Heptadecenoic acid cis-Tetradec-10-enoic acid (10Z)-10-Heptadecenoate (10Z)-Heptadec-10-enoate cis-10-Heptadecenoate cis-Tetradec-10-enoate 10Z-Heptadecenoate (Z)-10-Heptadecenoic acid 10-cis-Heptadecenoic acid 10-Heptadecenoate (17:1n7) FA(17:1(10Z)) 10Z-Heptadecenoic acid 10-Heptadecenoate FA(17:1n7) (10Z)-Heptadecenoate C17H32O2 268.4348 268.240230268 (10Z)-heptadec-10-enoic acid (10Z)-heptadec-10-enoic acid 29743-97-3 CCCCCC\C=C/CCCCCCCCC(O)=O InChI=1S/C17H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h7-8H,2-6,9-16H2,1H3,(H,18,19)/b8-7- GDTXICBNEOEPAZ-FPLPWBNLSA-N belongs to the class of organic compounds known as long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms. Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty acids and conjugates Long-chain fatty acids Carbonyl compounds Carboxylic acids Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Straight chain fatty acids Unsaturated fatty acids Aliphatic acyclic compound Carbonyl group Carboxylic acid Carboxylic acid derivative Hydrocarbon derivative Long-chain fatty acid Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Straight chain fatty acid Unsaturated fatty acid Aliphatic acyclic compounds 10-heptadecenoic acid Unsaturated fatty acids logp 7.21 ALOGPS logs -6.07 ALOGPS logp 6.34 ChemAxon pka_strongest_acidic 5.02 ChemAxon iupac (10Z)-heptadec-10-enoic acid ChemAxon average_mass 268.4348 ChemAxon mono_mass 268.240230268 ChemAxon smiles CCCCCC\C=C/CCCCCCCCC(O)=O ChemAxon formula C17H32O2 ChemAxon inchi InChI=1S/C17H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h7-8H,2-6,9-16H2,1H3,(H,18,19)/b8-7- ChemAxon inchikey GDTXICBNEOEPAZ-FPLPWBNLSA-N ChemAxon polar_surface_area 37.3 ChemAxon refractivity 82.8 ChemAxon polarizability 34.98 ChemAxon rotatable_bond_count 14 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon number_of_rings 0 ChemAxon bioavailability 0 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::CMs 36302 Specdb::CMs 48024 Specdb::CMs 151409 Specdb::MsMs 911644 Specdb::MsMs 911645 Specdb::MsMs 911646 Specdb::MsMs 958993 Specdb::MsMs 958994 Specdb::MsMs 958995 Specdb::MsMs 3224359 Specdb::MsMs 3224360 Specdb::MsMs 3224361 Specdb::MsMs 3225232 Specdb::MsMs 3225233 Specdb::MsMs 3225234 Specdb::NmrOneD 290835 Specdb::NmrOneD 290836 Specdb::NmrOneD 290837 Specdb::NmrOneD 290838 Specdb::NmrOneD 290839 Specdb::NmrOneD 290840 Specdb::NmrOneD 290841 Specdb::NmrOneD 290842 Specdb::NmrOneD 290843 Specdb::NmrOneD 290844 Specdb::NmrOneD 290845 Specdb::NmrOneD 290846 Specdb::NmrOneD 290847 Specdb::NmrOneD 290848 Specdb::NmrOneD 290849 Specdb::NmrOneD 290850 Specdb::NmrOneD 290851 Specdb::NmrOneD 290852 Specdb::NmrOneD 290853 Specdb::NmrOneD 290854 Liver Metabolomics analysis was performed using GC-MS/LC-MS in multiparous Holstein dairy cows Shahzad K, Lopreiato V, Liang Y, Trevisi E, Osorio JS, Xu C, Loor JJ: Hepatic metabolomics and transcriptomics to study susceptibility to ketosis in response to prepartal nutritional management. J Anim Sci Biotechnol. 2019 Dec 18;10:96. doi: 10.1186/s40104-019-0404-z. eCollection 2019. 31867104 Milk Raw milk from 6 Holstein and 6 Montbeliarde cows Lopez C, Briard-Bion V, Menard O, Rousseau F, Pradel P, Besle JM: Phospholipid, sphingolipid, and fatty acid compositions of the milk fat globule membrane are modified by diet. J Agric Food Chem. 2008 Jul 9;56(13):5226-36. doi: 10.1021/jf7036104. Epub 2008 Jun 4. 18522410 Milk Detected but not quantified in conventional whole milk Kurt J. Boudonck, Matthew W. Mitchell, Jacob Wulff and John A. Ryals. Characterization of the biochemical variability of bovine milk using metabolomics. Metabolomics (2009) 5:375?386 Milk Kurt J. Boudonck, Matthew W. Mitchell, Jacob Wulff, John A. Ryals. Characterization of the biochemical variability of bovine milk using metabolomics. Metabolomics (2009) 5:375-386 doi: 10.1007/s11306-009-0160-8 Milk This is a duplicate concentration of concentration_id 8146, unpexported by An Chi on Aug 20, 2018 Kurt J. Boudonck, Matthew W. Mitchell, Jacob Wulff, John A. Ryals. Characterization of the biochemical variability of bovine milk using metabolomics. Metabolomics (2009) 5:375-386 doi: 10.1007/s11306-009-0160-8 Placenta Wishart DS, Feunang YD, Marcu A, Guo AC, Liang K, Vazquez-Fresno R, Sajed T, Johnson D, Li C, Karu N, Sayeeda Z, Lo E, Assempour N, Berjanskii M, Singhal S, Arndt D, Liang Y, Badran H, Grant J, Serra-Cayuela A, Liu Y, Mandal R, Neveu V, Pon A, Knox C, Wilson M, Manach C, Scalbert A: HMDB 4.0: the human metabolome database for 2018. Nucleic Acids Res. 2018 Jan 4;46(D1):D608-D617. doi: 10.1093/nar/gkx1089. 29140435 4471860 5312435 75094 Lopez C, Briard-Bion V, Menard O, Rousseau F, Pradel P, Besle JM: Phospholipid, sphingolipid, and fatty acid compositions of the milk fat globule membrane are modified by diet. J Agric Food Chem. 2008 Jul 9;56(13):5226-36. doi: 10.1021/jf7036104. Epub 2008 Jun 4. 18522410 Kurt J. Boudonck, Matthew W. Mitchell, Jacob Wulff and John A. Ryals. Characterization of the biochemical variability of bovine milk using metabolomics. Metabolomics (2009) 5:375?386 Kurt J. Boudonck, Matthew W. Mitchell, Jacob Wulff, John A. Ryals. Characterization of the biochemical variability of bovine milk using metabolomics. Metabolomics (2009) 5:375-386 doi: 10.1007/s11306-009-0160-8