LMPR04000042 LIPID_MAPS_STRUCTURE_DATABASE 41 45 0 0 0 0 0 0 0 0999 V2000 8.6115 7.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4635 7.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4635 8.5315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6115 9.0234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3154 9.0234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3154 10.0071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4635 10.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6115 10.0071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1674 8.5315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0192 9.0234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1674 10.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1663 11.4828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0192 10.0071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8720 10.5008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8709 11.4846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7595 9.5137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4635 9.5137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3154 8.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1674 9.5169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7229 10.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5749 10.5026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4268 10.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1306 10.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9826 10.5026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8346 10.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1306 9.0287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9826 11.4847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8346 9.0287 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.2788 10.5026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2788 11.4847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7229 9.0287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0606 8.5242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0648 7.5405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9189 7.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9104 9.0274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7595 8.5315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7595 7.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2162 6.3606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6137 6.3666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8487 11.9847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8487 12.9846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 37 1 1 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 36 1 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 4 1 0 0 0 0 5 9 1 0 0 0 0 9 10 1 0 0 0 0 10 13 1 0 0 0 0 11 6 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 12 15 1 0 0 0 0 36 16 1 1 0 0 0 3 17 1 1 0 0 0 5 18 1 6 0 0 0 11 19 1 6 0 0 0 20 31 1 0 0 0 0 21 20 1 0 0 0 0 22 21 1 0 0 0 0 29 22 2 0 0 0 0 23 29 1 0 0 0 0 24 23 1 0 0 0 0 25 24 1 0 0 0 0 23 26 1 0 0 0 0 24 27 1 0 0 0 0 25 28 1 0 0 0 0 29 30 1 0 0 0 0 32 33 1 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 34 37 1 0 0 0 0 36 35 1 0 0 0 0 36 37 1 0 0 0 0 34 38 1 0 0 0 0 34 39 1 0 0 0 0 14 20 1 0 0 0 0 27 40 1 0 0 0 40 41 2 0 0 0 M END > LMPR04000042 > > 35-amino-32,33-dihydroxy-bacteriohop-31-ene-34-formate > C36H61NO4 > 571.46 > Prenol Lipids [PR] > Hopanoids [PR04] > > - > Delta-SC-O formylated aminotriol > JATWYUANSCAINE-WLFUBGJMSA-N > InChI=1S/C36H61NO4/c1-23(9-10-26(39)31(40)27(21-37)41-22-38)24-13-18-33(4)25(24)14-19-35(6)29(33)11-12-30-34(5)17-8-16-32(2,3)28(34)15-20-36(30,35)7/h10,22-25,27-31,39-40H,8-9,11-21,37H2,1-7H3/b26-10-/t23?,24?,25?,27?,28?,29?,30?,31?,33-,34-,35+,36+/m0/s1 > C1C[C@@]2(C)[C@]3(C)CCC4C(C(C/C=C(\O)/C(O)C(OC=O)CN)C)CC[C@]4(C)C3CCC2[C@@]2(C1C(C)(C)CCC2)C > - > - > - > - > - > - > - > - > - > - > - > - > 412755 > - $$$$