Ketcher 05161915312D 1 1.00000 0.00000 0 47 46 0 1 0 999 V2000 25.2036 -3.9431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.3310 -3.4406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4582 -3.9431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7080 -4.8156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.6992 -4.8156 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 26.0765 -3.4392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.9492 -3.9431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.7852 -5.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7852 -6.3404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.8060 -2.6180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.8447 -2.5986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.9058 -4.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0263 -5.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1468 -4.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2673 -5.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3878 -4.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5083 -5.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6288 -4.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7493 -5.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8698 -4.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9903 -5.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1108 -4.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2313 -5.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3519 -4.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4724 -5.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5929 -4.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7134 -5.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8339 -4.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9544 -5.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0749 -4.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1955 -5.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3160 -4.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4365 -5.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 -4.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9058 -4.3233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.5784 -3.4408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6989 -3.9431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8193 -3.4408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9399 -3.9431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0604 -3.4408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1810 -3.9431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3015 -3.4408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4219 -3.9431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5424 -3.4408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6629 -3.9431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7834 -3.4408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9041 -3.9431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 1 5 1 6 0 0 1 4 1 1 0 0 6 1 1 0 0 0 7 6 1 0 0 0 8 9 2 0 0 0 8 5 1 0 0 0 2 10 1 1 0 0 2 11 1 6 0 0 8 12 1 0 0 0 12 13 1 0 0 0 13 14 1 0 0 0 14 15 1 0 0 0 15 16 1 0 0 0 16 17 1 0 0 0 17 18 1 0 0 0 18 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 23 24 1 0 0 0 24 25 1 0 0 0 25 26 1 0 0 0 26 27 1 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 29 30 1 0 0 0 30 31 1 0 0 0 31 32 1 0 0 0 32 33 1 0 0 0 33 34 1 0 0 0 12 35 1 0 0 0 3 36 2 0 0 0 36 37 1 0 0 0 37 38 1 0 0 0 38 39 1 0 0 0 39 40 1 0 0 0 40 41 1 0 0 0 41 42 1 0 0 0 42 43 1 0 0 0 43 44 1 0 0 0 44 45 1 0 0 0 45 46 1 0 0 0 46 47 1 0 0 0 M END > CHEBI:143711 > N-(2-hydroxy-tetracosanoyl)-hexadecasphing-4-enine > 2 > Cer[AS]; Cer(d16:1(4E)/24:0(2OH)) > C40H79NO4 > 638.075 > 637.60091 > 0 > [C@]([C@@](/C=C/CCCCCCCCCCC)(O)[H])(NC(=O)C(CCCCCCCCCCCCCCCCCCCCCC)O)([H])CO > InChI=1S/C40H79NO4/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-25-27-29-31-33-35-39(44)40(45)41-37(36-42)38(43)34-32-30-28-26-24-14-12-10-8-6-4-2/h32,34,37-39,42-44H,3-31,33,35-36H2,1-2H3,(H,41,45)/b34-32+/t37-,38+,39?/m0/s1 > FLPBJVOYHZWCLM-DAEKEIETSA-N > LMSP02010086 $$$$