LMPR01070034 LIPID_MAPS_STRUCTURE_DATABASE 42 43 0 0 0 0 0 0 0 0999 V2000 7.6200 7.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6057 6.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4645 6.3358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3376 6.8235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3519 7.8233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4930 8.3357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0054 9.1944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0054 9.2086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1965 6.3112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2250 8.3109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0838 7.7987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9569 8.2862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8156 7.7740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6887 8.2616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5475 7.7494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4206 8.2370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2794 7.7246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1525 8.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0113 7.6999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8844 8.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7432 7.6753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6163 8.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4751 7.6506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3482 8.1382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2069 7.6260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.0800 8.1136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9388 7.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8118 8.0889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9712 9.2862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4348 9.2367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7290 6.6754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1928 6.6261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.6707 7.5765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.5438 8.0643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.5580 9.0640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.6992 9.5764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8261 9.0889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.1583 6.7178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1583 6.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9673 9.6011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 6.3605 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 28.4311 9.5517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 1 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 4 9 1 0 0 0 0 5 10 1 1 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 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 26 27 2 0 0 0 0 28 27 1 1 0 0 0 12 29 1 0 0 0 0 16 30 1 0 0 0 0 21 31 1 0 0 0 0 25 32 1 0 0 0 0 28 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 28 37 1 0 0 0 0 33 38 1 0 0 0 0 33 39 1 0 0 0 0 37 40 1 0 0 0 0 2 41 1 1 0 0 0 35 42 1 6 0 0 0 M END > LMPR01070034 > Tunaxanthin I > (3R,6R,3'S,6'R)-epsilon,epsilon-Carotene-3,3'-diol > C40H56O2 > 568.43 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > Chiriquixanthin A > BIPAHAFBQLWRMC-NXOKBDJASA-N > InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-26,35-38,41-42H,27-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36+,37-,38-/m0/s1 > C1C(C)(C)[C@@H](/C=C/C(/C)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/[C@H]2C(C)=C[C@H](O)CC2(C)C)C(C)=C[C@H]1O > - > - > - > - > - > - > 16061198 > VCA0032 > - > - > - > - > 8241; 47579 > - $$$$