HMDB0288402 RDKit 3D PC(22:5(7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,13E)-OH(15S)) 143142 0 0 0 0 0 0 0 0999 V2000 -7.2016 -0.6596 -9.8823 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4507 0.0877 -8.7542 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3638 0.1542 -7.6304 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0764 -0.3789 -6.4699 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8043 -1.1082 -6.1492 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2010 -2.4682 -5.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9830 -3.0444 -4.6394 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 -2.3049 -3.5605 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2377 -2.2865 -2.4123 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0308 -2.7928 -1.2448 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7703 -3.4673 -0.8889 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1141 -2.8521 0.2777 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9358 -2.3264 0.2662 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0734 -2.2617 -0.9265 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8226 -3.0138 -0.6922 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3533 -2.4453 -0.7097 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -1.0314 -0.9447 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4017 -0.5120 0.2802 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7446 0.9395 0.2096 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5016 1.7960 0.1386 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9055 3.2742 0.1022 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3393 4.1221 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8997 4.5436 -0.9264 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8591 4.4275 1.3132 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9818 5.1776 1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0402 5.1097 3.1904 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7005 5.6522 3.7239 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3051 4.9446 3.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8401 5.4479 3.5603 P 0 0 0 0 0 5 0 0 0 0 0 0 2.3918 4.4042 4.5039 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7645 6.9105 4.4036 O 0 0 0 0 0 1 0 0 0 0 0 0 2.8175 5.5497 2.2041 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0599 6.1145 2.4808 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9346 6.2084 1.2719 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4049 6.9979 0.2057 N 0 0 0 0 0 4 0 0 0 0 0 0 3.7859 8.2284 0.6441 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5599 7.4117 -0.6104 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5228 6.2976 -0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1478 3.7384 3.4703 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1968 3.1985 4.1908 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0900 3.9602 4.6372 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1862 1.7309 4.3817 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1933 1.2611 5.3871 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7657 1.6659 4.9866 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1202 1.0990 6.0149 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0625 0.2401 5.7283 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3315 -0.2482 4.3163 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7365 0.0922 3.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6683 -0.7502 3.6005 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3537 -2.1851 3.4745 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1623 -3.0428 4.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9231 -3.9791 3.8636 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0591 -4.2698 2.4566 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8647 -5.2684 2.0528 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9935 -5.5482 0.6144 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2184 -6.2376 0.4412 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9358 -6.4196 0.0365 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5362 -5.8956 0.1469 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6248 -6.9069 -0.5011 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1805 -6.4668 -0.4495 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2743 -7.4871 -1.1083 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5642 -0.6534 -10.7756 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2600 -1.7219 -9.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2067 -0.2195 -10.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5088 -0.4195 -8.6602 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3472 1.1245 -9.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3195 0.6536 -7.7209 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7795 -0.3230 -5.6182 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1144 -1.1992 -7.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2956 -0.4954 -5.4175 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7398 -3.0268 -6.5735 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3210 -4.0587 -4.4718 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3512 -2.8065 -3.2704 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0643 -1.2543 -3.7634 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2047 -1.7858 -2.6326 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8486 -2.7001 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1075 -3.7588 -1.6796 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1603 -4.4875 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6767 -2.8430 1.2222 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5065 -1.8769 1.2075 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5825 -2.6409 -1.8387 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8186 -1.2125 -1.1823 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8977 -4.0989 -0.4949 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2146 -3.1039 -0.5258 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1934 -0.4043 -1.1295 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4147 -1.0072 -1.7829 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7527 -0.6363 1.1922 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2835 -1.1528 0.4733 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2861 1.1832 1.1671 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4432 1.1873 -0.6215 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1263 1.5697 -0.7309 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 1.6680 1.0563 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 3.5088 -0.7663 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4651 3.4704 1.0173 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8801 4.6211 1.3106 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9392 6.2221 1.3189 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8655 5.7313 3.5206 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6804 6.7246 3.4967 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6814 5.4250 4.8091 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5641 5.4198 3.1932 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9679 7.0847 3.0396 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9084 6.6250 1.5787 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0827 5.1697 0.8995 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3641 8.7522 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9714 8.1010 1.3571 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5613 8.8879 1.0859 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8732 6.4730 -1.1536 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3685 7.8182 0.0137 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 8.0826 -1.3762 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2997 7.0144 -1.5253 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 5.4423 -1.1532 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5402 6.0305 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2065 1.4215 4.6904 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0362 1.2596 3.3827 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4278 1.6744 6.3696 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1818 0.1670 5.4494 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6167 1.3991 3.9654 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6966 2.7911 5.0319 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0181 1.3857 7.0765 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7056 -0.1688 6.4984 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1669 -1.3388 4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6323 0.1352 3.5827 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0163 1.1572 4.0527 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6676 -0.3926 3.3823 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6011 -2.4690 2.4037 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3095 -2.4201 3.6773 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1226 -2.8880 5.4681 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4943 -4.5799 4.5662 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5705 -3.7599 1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3980 -5.8453 2.7819 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0411 -4.6090 0.0045 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2355 -6.8883 1.2058 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1680 -6.5204 -1.0588 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 -7.4598 0.4273 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4761 -4.9560 -0.4401 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2418 -5.7253 1.1997 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9028 -7.0251 -1.5743 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7659 -7.8799 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0844 -5.4716 -0.9351 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8243 -6.3391 0.5877 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4443 -8.4831 -0.6823 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7585 -7.1547 -0.9827 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5602 -7.5122 -2.1989 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 2 0 29 31 1 0 29 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 35 37 1 0 35 38 1 0 26 39 1 0 39 40 1 0 40 41 2 0 40 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 2 0 46 47 1 0 47 48 1 0 48 49 2 0 49 50 1 0 50 51 1 0 51 52 2 0 52 53 1 0 53 54 2 0 54 55 1 0 55 56 1 0 55 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 1 62 1 0 1 63 1 0 1 64 1 0 2 65 1 0 2 66 1 0 3 67 1 0 4 68 1 0 5 69 1 0 5 70 1 0 6 71 1 0 7 72 1 0 8 73 1 0 8 74 1 0 9 75 1 0 10 76 1 0 11 77 1 0 11 78 1 0 12 79 1 0 13 80 1 0 14 81 1 0 14 82 1 0 15 83 1 0 16 84 1 0 17 85 1 0 17 86 1 0 18 87 1 0 18 88 1 0 19 89 1 0 19 90 1 0 20 91 1 0 20 92 1 0 21 93 1 0 21 94 1 0 25 95 1 0 25 96 1 0 26 97 1 1 27 98 1 0 27 99 1 0 33100 1 0 33101 1 0 34102 1 0 34103 1 0 36104 1 0 36105 1 0 36106 1 0 37107 1 0 37108 1 0 37109 1 0 38110 1 0 38111 1 0 38112 1 0 42113 1 0 42114 1 0 43115 1 0 43116 1 0 44117 1 0 44118 1 0 45119 1 0 46120 1 0 47121 1 0 47122 1 0 48123 1 0 49124 1 0 50125 1 0 50126 1 0 51127 1 0 52128 1 0 53129 1 0 54130 1 0 55131 1 6 56132 1 0 57133 1 0 57134 1 0 58135 1 0 58136 1 0 59137 1 0 59138 1 0 60139 1 0 60140 1 0 61141 1 0 61142 1 0 61143 1 0 M CHG 2 31 -1 35 1 M END