Marvin 03150710552D 17 16 0 0 0 0 999 V2000 -4.2868 -0.1941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5724 0.2184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8579 -0.1941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 0.2184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -0.1941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 0.2184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.1941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.2184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -0.1941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 0.2184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -0.1941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 0.2184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0013 0.2184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 -0.1941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7158 -0.1941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0013 0.2184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7158 -0.1941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 4 3 1 0 0 0 0 5 4 1 0 0 0 0 6 5 1 0 0 0 0 7 6 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 11 10 1 0 0 0 0 12 11 1 0 0 0 0 13 1 1 0 0 0 0 14 12 1 0 0 0 0 15 13 1 0 0 0 0 16 14 1 0 0 0 0 17 16 1 0 0 0 0 M END > CHEBI:16148 > heptadecane > A straight-chain alkane with 17 carbon atoms. It is a component of essential oils from plants like Opuntia littoralis and Annona squamosa. > 3 > CHEBI:14393; CHEBI:5671; CHEBI:24511 > n-heptadecane; Heptadekan; heptadecane; Heptadecane; CH3-[CH2]15-CH3 > heptadecane > C17H36 > 240.46774 > 240.28170 > 0 > CCCCCCCCCCCCCCCCC > InChI=1S/C17H36/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-17H2,1-2H3 > NDJKXXJCMXVBJW-UHFFFAOYSA-N > 1738898 > 629-78-7 > 1738898 > 629-78-7 > C01816 > C00030472 > LMFA11000003 > HEPTADECANE-CPD > 629-78-7 > Heptadecane > 19296389; 24354326 $$$$