LMST01040152 LIPID_MAPS_STRUCTURE_DATABASE 41 45 0 0 0 0 0 0 0 0999 V2000 6.9833 7.7225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9833 6.0725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1267 6.4850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6978 7.3100 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4123 8.5475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6258 7.4676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1108 8.1350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6978 8.1350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4123 7.7225 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4123 6.8975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1267 7.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8412 7.7225 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8412 8.5475 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8412 9.3725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0548 9.6274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4838 9.6274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1982 10.0399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9113 10.0399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7692 10.0399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6258 8.8024 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.3403 9.2149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6978 6.4850 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6978 5.6600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2689 7.3100 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5544 7.7225 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2689 6.4850 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5544 6.0725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4123 6.0725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4123 5.2475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8412 6.8975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1267 8.9600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1267 9.7850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6258 9.6274 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.6258 10.4524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7692 10.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4837 11.2774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3403 10.8649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0547 11.2774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0547 12.1024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3403 10.0399 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.0548 10.4524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12 13 1 0 0 0 0 13 20 1 0 0 0 0 13 31 1 0 0 0 0 11 12 1 0 0 0 0 12 6 1 0 0 0 0 9 5 1 0 0 0 0 9 4 1 0 0 0 0 11 9 1 0 0 0 0 11 3 2 0 0 0 0 4 22 1 0 0 0 0 4 8 1 1 0 0 0 4 1 1 0 0 0 0 20 7 1 0 0 0 0 5 31 1 0 0 0 0 7 6 1 0 0 0 0 28 3 1 0 0 0 0 22 2 1 0 0 0 0 22 28 1 0 0 0 0 24 1 1 0 0 0 0 26 2 1 0 0 0 0 26 24 1 0 0 0 0 9 10 1 6 0 0 0 12 30 1 6 0 0 0 13 14 1 1 0 0 0 15 40 1 0 0 0 0 15 19 1 0 0 0 0 33 40 1 0 0 0 0 20 33 1 0 0 0 0 16 19 1 0 0 0 0 17 16 1 0 0 0 0 33 18 1 6 0 0 0 19 35 2 0 0 0 0 20 21 1 6 0 0 0 35 38 1 0 0 0 0 22 23 1 1 0 0 0 24 25 1 1 0 0 0 26 27 1 1 0 0 0 28 29 2 0 0 0 0 31 32 2 0 0 0 0 33 34 1 1 0 0 0 40 37 1 0 0 0 0 37 38 1 0 0 0 0 35 36 1 0 0 0 0 38 39 2 0 0 0 0 40 41 1 1 0 0 0 M END > LMST01040152 > ajugalactone > (22R)-2beta,3beta,14,20-tetrahydroxy-22,26-epoxy-5beta-stigmasta-7,24-diene-6,12,26-trione > C29H40O8 > 516.27 > Sterol Lipids [ST] > Sterols [ST01] > Stigmasterols and C24-ethyl derivatives [ST0104] > - > Ajugalactone > C08810 > - > - > 27984 > - > - > - > - > - > 181744 > - > - > Active > - > https://lipidmaps.org/data/LMSDRecord.php?LMID=LMST01040152 $$$$