LMPR04000020 LIPID_MAPS_STRUCTURE_DATABASE 66 72 0 0 0 0 0 0 0 0999 V2000 5.0000 6.5755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 5.7874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6825 5.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3650 5.7874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3650 6.5755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6825 6.9695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0475 5.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 5.7874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 6.5755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0475 6.9695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4125 6.9695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4125 7.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 8.1517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0475 7.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0950 6.5755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7775 6.9695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0950 8.1517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0942 8.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7775 7.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4605 8.1531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4598 8.9412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3650 7.3622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 7.3622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3638 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0011 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4125 6.1828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0950 7.3649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5073 7.7605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8723 7.7605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5549 8.1545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2373 7.7605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8723 6.9737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5549 8.9412 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1899 8.1545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1899 8.9412 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2825 9.7293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6012 10.1227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9639 10.1227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6000 7.7605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6000 6.9724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2825 6.5783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9650 6.9724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9650 7.7605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2825 8.1545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2825 8.9412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.6464 6.5790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6464 8.1538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2825 5.7916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9639 5.3982 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9187 8.1538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8248 8.1545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1423 6.9737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1423 7.7605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6464 9.7287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3288 10.1227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0114 9.7287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6938 10.1227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3764 9.7287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0588 10.1227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7414 9.7287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.6060 9.4402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0000 10.1227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.6060 10.8052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8179 10.8052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4238 10.1227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8179 9.4402 0.0000 C 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 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 19 1 0 0 0 0 17 12 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 18 21 1 0 0 0 0 5 22 1 1 0 0 0 9 23 1 1 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 11 26 1 6 0 0 0 17 27 1 6 0 0 0 53 20 1 6 0 0 0 28 51 1 0 0 0 0 34 28 1 0 0 0 0 29 34 1 0 0 0 0 30 29 1 0 0 0 0 31 30 1 0 0 0 0 29 32 1 6 0 0 0 30 33 1 1 0 0 0 34 35 1 1 0 0 0 31 50 1 0 0 0 0 45 36 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 39 1 0 0 0 0 44 45 1 6 0 0 0 42 46 1 6 0 0 0 43 47 1 1 0 0 0 41 48 1 1 0 0 0 48 49 1 0 0 0 0 39 50 1 1 0 0 0 51 53 1 0 0 0 0 53 52 1 0 0 0 0 54 38 1 0 0 0 0 55 54 1 0 0 0 0 56 55 1 0 0 0 0 57 56 1 0 0 0 0 58 57 1 0 0 0 0 59 58 1 0 0 0 0 60 59 1 0 0 0 0 65 60 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 65 1 0 0 0 0 65 66 1 0 0 0 0 66 61 1 0 0 0 0 M END > LMPR04000020 > bacteriohopane-,32,33,34-triol-35-(N-(9-cyclohexyl-nonanoyl))-glucosamine > > C56H99NO9 > 929.73 > Prenol Lipids [PR] > Hopanoids [PR04] > > - > > CUHLLNXUAKMTSY-VESYUJKXSA-N > InChI=1S/C56H99NO9/c1-36(38-26-31-53(4)39(38)27-32-55(6)44(53)24-25-45-54(5)30-17-29-52(2,3)43(54)28-33-56(45,55)7)22-23-40(59)48(62)41(60)35-65-51-47(50(64)49(63)42(34-58)66-51)57-46(61)21-16-11-9-8-10-13-18-37-19-14-12-15-20-37/h36-45,47-51,58-60,62-64H,8-35H2,1-7H3,(H,57,61)/t36-,38?,39?,40+,41-,42+,43?,44?,45?,47+,48+,49+,50+,51+,53-,54-,55+,56+/m0/s1 > C1C[C@]2(C)C3CCC4[C@]5(C)C(C([C@@H](C)CC[C@@H](O)[C@@H](O)[C@@H](O)CO[C@H]6[C@H](NC(CCCCCCCCC7CCCCC7)=O)[C@@H](O)[C@H](O)[C@@H](CO)O6)CC5)CC[C@@]4(C)[C@]3(C)CCC2C(C)(C)C1 > - > - > - > - > - > - > 42608327 > - > - > - > - > - > 2 > 17294511 $$$$