HMDB0287660 RDKit 3D PC(20:3(5Z,11Z,14Z)-O(8,9)/20:5(5Z,8Z,11Z,14Z,17Z)) 137137 0 0 0 0 0 0 0 0999 V2000 2.7017 4.4338 -4.1934 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8417 3.4615 -5.3727 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5151 2.9123 -5.6477 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1553 1.6595 -5.5923 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1765 0.6405 -5.2047 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4057 -0.3007 -6.2993 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3142 -1.5785 -6.3381 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9313 -2.4465 -5.1921 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7642 -3.1869 -5.6026 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 -3.3930 -4.9982 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7849 -2.9901 -3.6984 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -2.2424 -3.7504 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2775 -1.1340 -3.1278 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3528 -0.4270 -2.2635 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2506 0.9797 -2.7381 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6157 2.0168 -1.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1557 1.8927 -0.6434 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 2.4469 -0.6889 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2485 2.3656 0.5957 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6788 3.1323 1.6996 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4889 3.3951 2.6889 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4335 3.6404 1.9006 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0348 4.3773 3.0070 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7628 5.8239 2.7914 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8399 6.2337 1.8495 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8828 6.0313 0.5101 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9029 5.3532 0.0998 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0197 6.4522 -0.5652 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 5.4141 -1.2643 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 4.6654 -0.5737 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5807 3.9190 0.6321 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7543 2.6210 0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2191 1.6857 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5258 1.0860 0.0495 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0073 0.1343 -0.8909 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9436 -0.2057 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1321 -1.3665 0.8994 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0705 -2.4853 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9945 -3.6657 0.5998 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9038 -4.0667 -0.3304 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2789 -5.2755 0.3308 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0612 -5.4018 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0497 -4.3464 0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1524 -4.8541 -0.2029 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1481 -3.7228 -0.2551 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3909 -4.1034 -1.0299 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3256 -2.9134 -1.0089 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1672 3.7181 4.0195 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0456 3.2425 3.6630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7487 2.6033 5.0914 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.3092 2.2665 6.1086 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7867 3.7378 5.7914 O 0 0 0 0 0 1 0 0 0 0 0 0 1.5970 1.1970 4.7328 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1688 0.1202 5.5085 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9741 -1.0827 5.1535 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3838 -0.9228 5.3804 N 0 0 0 0 0 4 0 0 0 0 0 0 3.6583 -0.5560 6.7758 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0616 -2.1813 5.1459 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 0.0731 4.5173 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7692 4.1436 -3.6662 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5439 4.2506 -3.4735 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6626 5.4686 -4.5253 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6631 2.8056 -5.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1671 4.1181 -6.2521 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7442 3.6569 -5.9336 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1371 1.3967 -5.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0581 1.1238 -4.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7083 0.1307 -4.2987 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7155 0.1934 -7.2683 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5364 -2.1095 -7.3072 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8171 -3.1376 -4.9843 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8529 -1.8239 -4.3122 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8587 -3.6515 -6.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1203 -4.0195 -5.5542 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0128 -2.5691 -3.0293 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0575 -3.9720 -3.1497 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8671 -2.6917 -4.3972 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2993 -0.6737 -3.2702 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6794 -0.5176 -1.2198 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3128 -0.8465 -2.2632 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8778 1.2295 -3.7226 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5129 3.0423 -2.4118 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5434 2.5217 0.0588 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1758 0.9070 -0.2288 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1572 1.9099 -1.4749 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5666 3.5279 -1.0178 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4086 1.2722 0.9194 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3165 2.6965 0.4399 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 4.4375 3.6251 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3888 6.2193 3.7897 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7494 6.3917 2.6869 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 7.3435 -0.2666 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6646 6.9104 -1.3538 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2987 5.9069 -2.1696 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0436 4.7390 -1.7817 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3806 4.0471 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7064 5.3943 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2126 4.4368 1.5633 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5228 2.1651 1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3168 2.1529 -1.3274 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4437 0.8733 -0.5043 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3152 1.9217 0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0053 -0.2640 0.8844 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 -1.5508 0.1504 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5864 -1.1469 1.8476 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9224 -2.2623 1.8329 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7764 -4.4352 0.8413 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2085 -3.3066 -0.6151 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4107 -4.4914 -1.2433 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 -6.1136 0.4519 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7179 -6.3404 1.2104 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3685 -4.1792 1.6336 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -3.4326 0.1213 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -5.6809 0.3691 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8465 -5.2445 -1.1672 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4441 -3.4490 0.7724 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6676 -2.8959 -0.8093 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1826 -4.3844 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8745 -4.9348 -0.4561 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8627 -2.7858 -1.9636 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7433 -1.9954 -0.7943 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0491 -2.9913 -0.1481 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0222 4.4405 4.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7546 2.8649 4.4791 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2462 0.3360 6.5873 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -0.1201 5.3152 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8268 -1.3730 4.1058 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6628 -1.9841 5.7578 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3867 0.4976 6.9008 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7618 -0.7005 6.9486 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1319 -1.2557 7.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1332 -2.0570 5.4195 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6589 -2.9937 5.7928 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0478 -2.4764 4.0725 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3934 0.2424 3.6129 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1328 1.0217 5.1101 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0104 -0.2162 4.1987 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 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 2 0 39 40 1 0 40 41 1 0 41 42 2 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 23 48 1 0 48 49 1 0 49 50 1 0 50 51 2 0 50 52 1 0 50 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 56 58 1 0 56 59 1 0 36 34 1 0 1 60 1 0 1 61 1 0 1 62 1 0 2 63 1 0 2 64 1 0 3 65 1 0 4 66 1 0 5 67 1 0 5 68 1 0 6 69 1 0 7 70 1 0 8 71 1 0 8 72 1 0 9 73 1 0 10 74 1 0 11 75 1 0 11 76 1 0 12 77 1 0 13 78 1 0 14 79 1 0 14 80 1 0 15 81 1 0 16 82 1 0 17 83 1 0 17 84 1 0 18 85 1 0 18 86 1 0 19 87 1 0 19 88 1 0 23 89 1 1 24 90 1 0 24 91 1 0 28 92 1 0 28 93 1 0 29 94 1 0 29 95 1 0 30 96 1 0 30 97 1 0 31 98 1 0 32 99 1 0 33100 1 0 33101 1 0 34102 1 0 36103 1 0 37104 1 0 37105 1 0 38106 1 0 39107 1 0 40108 1 0 40109 1 0 41110 1 0 42111 1 0 43112 1 0 43113 1 0 44114 1 0 44115 1 0 45116 1 0 45117 1 0 46118 1 0 46119 1 0 47120 1 0 47121 1 0 47122 1 0 48123 1 0 48124 1 0 54125 1 0 54126 1 0 55127 1 0 55128 1 0 57129 1 0 57130 1 0 57131 1 0 58132 1 0 58133 1 0 58134 1 0 59135 1 0 59136 1 0 59137 1 0 M CHG 2 52 -1 56 1 M END