PE(17:0cycw7/10:0(3-OH)) Mrv1652308101903272D 44 44 0 0 1 0 999 V2000 19.3839 -5.5239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7088 -5.9135 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 18.0337 -5.5239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0590 -5.9135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3586 -5.9135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1819 -6.6932 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7340 -5.5239 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 20.3443 -4.8487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1238 -6.1990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.4092 -5.1341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.0843 -5.5239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7594 -5.1341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4345 -5.5239 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.2965 -6.7228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6440 -5.5010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6440 -4.7296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9299 -5.9142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2157 -5.5010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5016 -5.9142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7875 -5.5010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0734 -5.9142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3593 -5.5010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6452 -5.9142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9311 -5.5010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2170 -5.9142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5028 -5.5010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7887 -5.9142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0746 -5.5010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3605 -5.9142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6463 -5.5010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9322 -5.9142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2181 -5.5010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4675 -7.1057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4675 -7.8771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7534 -6.6925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0392 -7.1057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0392 -7.8771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3251 -6.6925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6110 -7.1057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8969 -6.6925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1828 -7.1057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4686 -6.6925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7545 -7.1057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0404 -6.6925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 2 6 1 0 0 0 0 2 14 1 1 0 0 0 3 2 1 0 0 0 0 4 1 1 0 0 0 0 5 3 1 0 0 0 0 5 15 1 0 0 0 0 7 4 1 0 0 0 0 8 7 2 0 0 0 0 9 7 1 0 0 0 0 10 7 1 0 0 0 0 11 10 1 0 0 0 0 12 11 1 0 0 0 0 13 12 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 33 6 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 M END > M2MDB003899 > M2MDB > [H][C@@](COC(=O)CCCCCCCC1CC1CCCCCC)(COP(O)(=O)OCCN)OC(=O)CC(O)CCCCCCC > InChI=1S/C32H62NO9P/c1-3-5-7-10-15-19-29(34)24-32(36)42-30(26-41-43(37,38)40-22-21-33)25-39-31(35)20-16-12-9-11-14-18-28-23-27(28)17-13-8-6-4-2/h27-30,34H,3-26,33H2,1-2H3,(H,37,38)/t27?,28?,29?,30-/m1/s1 > DBELLPBYTZDJHZ-VXBYCJGMSA-N > C32H62NO9P > 635.82 > 635.416219578 > 6 > 105 > 73.77417796933979 > 0 > 3 > 0 > 0 > (2-aminoethoxy)[(2R)-3-{[8-(2-hexylcyclopropyl)octanoyl]oxy}-2-[(3-hydroxydecanoyl)oxy]propoxy]phosphinic acid > 5.52 > 6.21843592670294 > -6.20 > 0 > 1 > 0 > 15.00009795155146 > 1.8688003132175717 > 9.999924995081619 > 154.60999999999999 > 167.60739999999998 > 32 > 0 > 4.00e-04 g/l > 2-aminoethoxy((2R)-3-{[8-(2-hexylcyclopropyl)octanoyl]oxy}-2-[(3-hydroxydecanoyl)oxy]propoxy)phosphinic acid > 0 > ECMDB23509 > PE(17:0cycw7c/10:0(3-OH)) $$$$