LMPR04000011 LIPID_MAPS_STRUCTURE_DATABASE 50 55 0 0 0 999 V2000 18.8594 9.9921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0100 10.4846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5623 9.9963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6648 9.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6251 8.8104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1174 9.6680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4650 10.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1023 9.6721 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.6566 8.0349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8072 8.5354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5488 7.5834 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.7194 11.3669 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 22.1133 7.9568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.6966 10.4970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0059 11.4818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1687 9.9881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9052 11.4572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2023 11.4653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1982 10.4763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0559 9.9757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0606 8.5354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0606 7.5465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9099 7.0582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9099 9.0320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7594 8.5354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7554 7.5465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6007 7.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4624 7.5424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6088 9.0279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4665 8.5190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4870 10.5011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6171 10.0127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3365 9.9921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3241 9.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1653 8.4944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0353 8.9745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7513 9.5203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2001 6.3606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5994 6.3606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3119 8.0143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1858 9.4956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4583 9.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7505 9.9840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6000 10.4763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7423 8.9950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4534 9.9840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3029 10.4805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8847 10.4805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2989 11.4777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1769 8.9909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 1 14 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 7 1 0 0 0 0 7 3 1 0 0 0 0 6 8 1 1 0 0 0 4 10 1 1 0 0 0 10 11 1 0 0 0 0 3 14 1 4 0 0 0 2 15 1 1 0 0 0 2 16 1 0 0 0 0 48 17 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 48 1 0 0 0 0 17 18 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 23 26 1 0 0 0 0 25 24 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 30 1 0 0 0 0 29 30 1 0 0 0 0 29 32 1 0 0 0 0 30 34 1 0 0 0 0 33 31 1 0 0 0 0 31 32 1 0 0 0 0 33 34 1 0 0 0 0 33 19 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 20 1 0 0 0 0 25 37 1 1 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 34 40 1 6 0 0 0 19 41 1 6 0 0 0 30 42 1 1 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 44 46 1 0 0 0 0 46 47 1 0 0 0 0 43 48 1 6 0 0 0 47 49 1 1 0 0 0 47 16 1 0 0 0 0 7 12 1 6 0 0 0 5 13 1 6 0 0 0 4 9 1 6 0 0 0 16 50 1 6 0 0 0 M END > LMPR04000011 > bacteriohopane-,32,33,34-triol-35-cyclitol > > C41H73NO8 > 707.53 > Prenol Lipids [PR] > Hopanoids [PR04] > > - > > AGAUYSZNDYQXOM-WGZGYOGDSA-N > InChI=1S/C41H73NO8/c1-23(9-10-26(44)32(46)27(45)21-50-35-31(42)33(47)34(48)41(35,49)22-43)24-13-18-37(4)25(24)14-19-39(6)29(37)11-12-30-38(5)17-8-16-36(2,3)28(38)15-20-40(30,39)7/h23-35,43-49H,8-22,42H2,1-7H3/t23-,24?,25?,26+,27-,28?,29?,30?,31+,32+,33+,34-,35?,37-,38-,39+,40+,41-/m0/s1 > C(OC1[C@H](N)[C@@H](O)[C@H](O)[C@@]1(O)CO)[C@@H]([C@H](O)[C@H](O)CC[C@@H](C1C2CC[C@]3(C)C([C@@]2(C)CC1)CCC1[C@@]3(C)CCC2[C@]1(C)CCCC2(C)C)C)O > - > - > - > - > - > - > 42608318 > - > - > - > - > - > 2 > 17294511 $$$$