Ketcher 11161615062D 1 1.00000 0.00000 0 34 33 0 1 0 999 V2000 18.3776 -5.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2433 -5.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6454 -5.2638 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 14.0471 -5.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1811 -5.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9131 -5.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4488 -5.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5113 -5.7637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.9755 -5.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3151 -5.7637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7793 -5.7637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5830 -5.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1095 -5.2638 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.6454 -4.2636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.1095 -4.2636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0473 -6.7634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6454 -6.2634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.9758 -4.7635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7169 -5.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8509 -5.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9848 -5.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1190 -5.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2528 -5.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2528 -4.2636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1190 -3.7636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9848 -4.2636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8509 -3.7636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1812 -7.2634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7168 -4.2636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3867 -3.7636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5205 -4.2637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3867 -5.7639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5205 -5.2639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4487 -4.2639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 14 3 2 0 0 0 3 17 1 0 0 0 4 16 1 6 0 0 4 5 1 0 0 0 4 6 1 0 0 0 1 8 1 0 0 0 8 3 1 0 0 0 7 10 1 0 0 0 10 5 1 0 0 0 11 6 1 0 0 0 3 11 1 0 0 0 12 7 1 0 0 0 9 13 1 0 0 0 13 2 1 0 0 0 15 13 1 0 0 0 13 18 1 0 0 0 12 19 1 0 0 0 19 20 1 0 0 0 20 21 1 0 0 0 21 22 1 0 0 0 22 23 1 0 0 0 24 25 1 0 0 0 25 26 1 0 0 0 26 27 1 0 0 0 16 28 1 0 0 0 27 29 1 0 0 0 30 24 1 0 0 0 31 30 1 0 0 0 32 23 1 0 0 0 33 31 1 0 0 0 33 32 1 0 0 0 7 34 2 0 0 0 M CHG 2 13 1 17 -1 M END > CHEBI:131689 > 1-hexadecanoyl-2-methyl-sn-glycero-3-phosphocholine > A 1-acyl-2-alkyl-sn-glycero-3-phosphocholine in which the acyl and alkyl groups at posiitons 1 and 2 are specified respectively as hexadecanoyl and methyl. > 3 > PC(16:0/O-1:0); 1-palmitoyl-2-methyl-sn-glycero-3-phosphocholine > (2R)-3-(hexadecanoyloxy)-2-methoxypropyl 2-(trimethylazaniumyl)ethyl phosphate > C25H52NO7P > 509.658 > 509.34814 > 0 > C(C[N+](C)(C)C)OP(=O)([O-])OC[C@H](OC)COC(CCCCCCCCCCCCCCC)=O > InChI=1S/C25H52NO7P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(27)31-22-24(30-5)23-33-34(28,29)32-21-20-26(2,3)4/h24H,6-23H2,1-5H3/t24-/m1/s1 > AEGNMLQHVFYYLW-XMMPIXPASA-N > LMGP01080021 $$$$