LMPR01080036 LIPID_MAPS_STRUCTURE_DATABASE 65 65 0 0 0 999 V2000 12.6852 -14.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5318 -13.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4281 -14.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2747 -13.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1212 -14.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0174 -13.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8640 -14.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7104 -13.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6069 -14.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4533 -13.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2998 -14.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1960 -13.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0424 -14.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8891 -13.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7355 -14.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.6319 -13.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.4783 -14.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.3248 -13.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2747 -12.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7104 -12.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0424 -15.1242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.4783 -15.1242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8388 -13.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9425 -14.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0961 -13.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2495 -14.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3532 -13.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8388 -12.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3532 -12.6344 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 28.1713 -14.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.0676 -13.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.9142 -14.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.7607 -13.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.6570 -14.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.5035 -13.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.3499 -14.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.2463 -13.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.9142 -15.1242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3573 -14.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.3377 -15.1386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2621 -15.1386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3856 -15.6498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3988 -16.6490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2632 -17.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5423 -17.1586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 32.5181 -12.6087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.3825 -12.1046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.3780 -11.1039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.5072 -10.6062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.2371 -10.6027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4866 -13.1300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3988 -17.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.2166 -14.6285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.3780 -10.1032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8171 -17.1586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9547 -17.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9547 -18.6527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8171 -19.1506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6797 -18.6527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6797 -17.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5423 -19.1506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8171 -20.1466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0921 -19.1506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0921 -17.1586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2295 -17.6566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 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 4 19 1 0 0 0 0 8 20 1 0 0 0 0 13 21 1 0 0 0 0 17 22 1 0 0 0 0 1 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 1 0 0 0 0 23 28 1 0 0 0 0 27 29 1 0 0 0 0 18 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 32 38 1 0 0 0 0 27 39 1 0 0 0 0 36 40 1 0 0 0 0 26 41 1 6 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 35 46 1 6 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 27 51 1 0 0 0 0 43 52 1 0 0 0 0 36 53 1 0 0 0 0 48 54 1 0 0 0 0 55 56 1 0 0 0 0 55 60 1 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 58 59 1 0 0 0 0 59 60 1 0 0 0 0 59 61 1 6 0 0 0 58 62 1 1 0 0 0 57 63 1 6 0 0 0 56 64 1 1 0 0 0 64 65 1 0 0 0 0 60 45 1 1 0 0 0 M END > LMPR01080036 > Bacterioruberin monoglucoside > (2S,2'S)-2-(3-Glucosyloxy-3-methylbutyl)-2'-(3-hydroxy-3-methylbutyl)-3,4,3',4'-tetradehydro-1,2,1',2'-tetrahydro-psi,psi-carotene-1,1'-diol > C56H86O9 > 902.63 > Prenol Lipids [PR] > Isoprenoids [PR01] > Polyterpenes [PR0108] > - > > POVGDUDBCMCUCT-OITKYQALSA-N > InChI=1S/C56H86O9/c1-40(23-17-25-42(3)27-19-29-44(5)31-33-46(55(11,12)62)35-37-53(7,8)61)21-15-16-22-41(2)24-18-26-43(4)28-20-30-45(6)32-34-47(56(13,14)63)36-38-54(9,10)65-52-51(60)50(59)49(58)48(39-57)64-52/h15-34,46-52,57-63H,35-39H2,1-14H3/b16-15+,23-17+,24-18+,27-19+,28-20+,33-31+,34-32+,40-21+,41-22+,42-25+,43-26+,44-29+,45-30+/t46-,47-,48-,49-,50+,51-,52+/m1/s1 > C(=C(/C)\C=C\[C@H](CCC(C)(O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)C)C(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/C=C(\C)/C=C/[C@H](CCC(O)(C)C)C(C)(O)C > - > - > - > - > - > - > 102060411 > - > - > - > - > - > 1275 > - $$$$