LMPR01070265 LIPID_MAPS_STRUCTURE_DATABASE 43 44 0 0 0 999 V2000 26.0281 9.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.0318 9.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7175 10.2376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7653 8.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0245 9.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.3423 10.2376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.2886 8.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.9994 9.0249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.5301 10.8291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9050 7.8181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.6315 7.8122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.5181 11.8326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.0388 8.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1726 7.8241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3125 8.3200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1726 6.8206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4462 7.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5800 8.3258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7138 7.8361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8476 8.3319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7078 6.8325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9873 7.8361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1211 8.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2549 7.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3886 8.3439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5224 7.8481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3886 9.3416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6563 8.3498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7901 7.8539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9238 8.3498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0636 7.8600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9298 9.3536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1975 8.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3371 7.8659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4709 8.3617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3371 6.8623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5988 7.8659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9609 9.2339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9572 9.2339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4709 6.3606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1975 6.3606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5988 6.8623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 6.3665 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 6 0 0 0 1 5 1 1 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 3 9 1 0 0 0 0 4 10 1 0 0 0 0 4 11 2 0 0 0 0 9 12 1 1 0 0 0 10 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 33 2 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 2 0 0 0 0 35 37 1 0 0 0 0 35 38 1 0 0 0 0 35 39 1 0 0 0 0 36 40 1 0 0 0 0 36 41 1 0 0 0 0 37 42 1 0 0 0 0 42 43 1 1 0 0 0 6 9 1 0 0 0 0 40 42 1 0 0 0 0 M END > LMPR01070265 > Capsanthin > (3R,3'S,5'R)-3,3'-Dihydroxy-beta,kappa-caroten-6'-one > C40H56O3 > 584.42 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > > VYIRVAXUEZSDNC-RDJLEWNRSA-N > InChI=1S/C40H56O3/c1-29(17-13-19-31(3)21-23-36-33(5)25-34(41)26-38(36,6)7)15-11-12-16-30(2)18-14-20-32(4)22-24-37(43)40(10)28-35(42)27-39(40,8)9/h11-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t34-,35+,40+/m1/s1 > [C@]1(C)(C(=O)/C=C/C(/C)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C2=C(C)C[C@@H](O)CC2(C)C)C[C@H](CC1(C)C)O > C08584 > - > 3375 > - > 18264 > - > 5281228 > - > - > - > - > - > 4072 > - $$$$