LMST04010451 LIPID_MAPS_STRUCTURE_DATABASE 43 47 0 0 0 999 V2000 5.8620 -3.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7487 -3.9421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7487 -4.9660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8620 -5.4780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9753 -4.9660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9753 -3.9421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6355 -3.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5223 -3.9421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5223 -4.9660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6354 -5.4780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6355 -2.4061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5223 -1.8942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4089 -2.4061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4089 -3.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4106 -2.1933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9225 -3.0800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2373 -3.8410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0885 -3.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0885 -2.4062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0885 -5.4780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8270 -1.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4667 -1.3948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -2.9531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5313 -3.1834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7397 -5.6539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2553 -5.4012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5223 -1.1006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8453 -1.1508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2251 -0.4294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4472 -1.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4655 -1.8721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0673 -2.7005 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0787 -2.8606 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.9849 -3.7654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2111 -1.9113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0900 -3.0208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2017 -1.8943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2017 -0.8703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0885 -0.3584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9753 -0.8703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9753 -1.8943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6355 -4.2802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4678 -4.1461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 6 1 1 0 0 0 2 7 1 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 9 10 1 0 0 0 10 3 1 0 0 0 7 11 1 0 0 0 11 12 1 0 0 0 12 13 1 0 0 0 13 14 1 0 0 0 14 8 1 0 0 0 13 15 1 0 0 0 15 16 1 0 0 0 16 17 1 0 0 0 17 14 1 0 0 0 6 18 2 0 0 0 18 19 1 0 0 0 5 20 2 0 0 0 15 21 1 1 0 0 13 22 1 1 0 0 2 23 1 1 0 0 8 24 1 1 0 0 3 25 1 6 0 0 9 26 1 6 0 0 12 27 1 6 0 0 21 28 1 0 0 0 21 29 1 6 0 0 28 30 1 0 0 0 30 31 1 0 0 0 31 32 1 0 0 0 32 33 1 0 0 0 33 34 2 0 0 0 33 35 2 0 0 0 33 36 1 0 0 0 19 37 1 0 0 0 37 38 2 0 0 0 38 39 1 0 0 0 39 40 2 0 0 0 40 41 1 0 0 0 41 19 2 0 0 0 7 42 1 6 0 0 14 43 1 6 0 0 M END > LMST04010451 > E-Petromylidene B > 2-(E)-benzylidene-7alpha,12alpha,24-trihydroxy-5alpha-cholan-3-one-24-sulfate > C31H44O7S > 560.28 > Sterol Lipids [ST] > Bile acids and derivatives [ST04] > C24 bile acids, alcohols, and derivatives [ST0401] > - > > - > - > - > - > - > - > - > - > - > 171120140 > - > - > Active > - > https://lipidmaps.org/databases/lmsd/LMST04010451 $$$$