HMDB0032298 RDKit 3D Glyceryl lactooleate 74 73 0 0 0 0 0 0 0 0999 V2000 -11.0501 1.0745 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1293 1.8615 -0.9954 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6772 1.6853 -0.6272 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2275 0.2617 -0.7074 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7184 0.2644 -0.2971 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2012 -1.1188 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8399 -1.4501 0.0412 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6468 -0.8817 -0.6403 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4326 0.5475 -0.5619 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3443 1.0348 0.0131 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2452 0.2919 0.6268 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0143 0.6802 -0.1616 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2534 -0.0087 0.3746 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1642 -1.4867 0.3055 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4344 -2.1276 0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6991 -1.7762 2.2287 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9360 -2.4262 2.7827 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1407 -1.9984 2.0446 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2746 -2.5384 2.2758 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1232 -1.0136 1.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3405 -0.6315 0.3896 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0697 -0.9358 -1.0446 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7174 -2.3176 -1.0808 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5497 0.8057 0.7292 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6127 1.4321 0.2171 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7367 1.6748 -1.1107 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0839 1.0841 -1.5493 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8254 3.1731 -1.3361 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7716 3.8957 -0.3152 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9589 3.6800 -2.6247 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4763 0.6397 0.7291 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5411 0.2448 -0.6645 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8639 1.6705 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3626 2.9491 -0.9693 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3126 1.5468 -2.0588 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5248 2.1308 0.3709 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0865 2.2969 -1.3331 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7933 -0.4076 -0.0353 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2214 -0.0714 -1.7645 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6765 0.7635 0.6629 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3049 0.9654 -1.0757 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8966 -1.7264 0.3317 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4385 -1.6034 -1.3554 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7204 -2.5877 0.0165 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7378 -1.2720 1.1826 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 -1.5111 -0.3224 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7096 -1.1462 -1.7656 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1697 1.2336 -1.0032 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2643 2.1365 0.0266 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2892 -0.7853 0.6189 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0445 0.6168 1.6835 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1282 1.7712 -0.0588 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1851 0.3457 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4801 0.4157 1.3774 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0792 0.3077 -0.3106 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0101 -1.7443 -0.7846 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3067 -1.9263 0.8706 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2399 -1.8129 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3943 -3.2457 0.6841 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7712 -0.6569 2.3195 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8645 -2.0630 2.9105 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8050 -3.5392 2.6766 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1062 -2.1737 3.8502 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1385 -1.2734 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0255 -0.8860 -1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2817 -0.3828 -1.5279 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5430 -2.8598 -0.9201 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6237 0.8953 1.8652 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5839 1.3624 0.5145 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9064 1.3604 -1.7598 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0623 0.8843 -2.6422 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8940 1.8202 -1.3772 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3293 0.1680 -0.9922 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6328 4.4133 -2.8614 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 21 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 26 28 1 0 28 29 2 0 28 30 1 0 1 31 1 0 1 32 1 0 1 33 1 0 2 34 1 0 2 35 1 0 3 36 1 0 3 37 1 0 4 38 1 0 4 39 1 0 5 40 1 0 5 41 1 0 6 42 1 0 6 43 1 0 7 44 1 0 7 45 1 0 8 46 1 0 8 47 1 0 9 48 1 0 10 49 1 0 11 50 1 0 11 51 1 0 12 52 1 0 12 53 1 0 13 54 1 0 13 55 1 0 14 56 1 0 14 57 1 0 15 58 1 0 15 59 1 0 16 60 1 0 16 61 1 0 17 62 1 0 17 63 1 0 21 64 1 0 22 65 1 0 22 66 1 0 23 67 1 0 24 68 1 0 24 69 1 0 26 70 1 0 27 71 1 0 27 72 1 0 27 73 1 0 30 74 1 0 M END