LMST01160014 LIPID_MAPS_STRUCTURE_DATABASE 39 43 0 0 0 999 V2000 -0.5761 -0.7843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9024 -2.2829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9024 -1.2837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0364 -0.7843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0364 0.2148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3062 0.2148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4403 0.7143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5761 0.2148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1705 -0.2847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1705 -1.2837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3062 -0.7843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4403 -1.2837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4403 -2.2829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3062 -2.7824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3062 -3.7816 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.1705 -3.2820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1705 -2.2829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0364 -2.7824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0364 -3.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2892 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1545 0.2149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1545 -0.7843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2892 1.7189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1589 2.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5806 2.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 3.2255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0288 3.7276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8986 3.2255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8986 2.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0288 1.7189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0288 4.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7684 3.7276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7684 1.7189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5759 1.2192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1148 2.7080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2783 0.8889 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3528 -0.4840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3062 -1.5376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 1.5584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 12 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 10 11 1 0 0 0 0 10 17 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 15 1 6 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 1 0 0 0 17 16 1 1 0 0 0 10 9 1 1 0 0 0 8 20 1 0 0 0 20 21 1 0 0 0 21 22 1 0 0 0 1 22 2 0 0 0 20 23 1 0 0 0 23 24 1 0 0 0 23 25 1 0 0 0 24 26 1 0 0 0 26 27 1 0 0 0 27 28 2 0 0 0 28 29 1 0 0 0 29 30 1 0 0 0 30 24 1 0 0 0 27 31 1 0 0 0 28 32 1 0 0 0 29 33 2 0 0 0 8 34 1 1 0 0 23 35 1 1 0 0 20 36 1 1 0 0 12 37 1 1 0 0 11 38 1 6 0 0 24 39 1 6 0 0 M END > LMST01160014 > Physalolactone C > 17S,20S,22R-6alpha-chloro-4beta,5beta,17beta,20alpha-tetrahydroxy-1-oxo-ergosta-2,14,24-trienolide > C28H37O7Cl > 520.22 > Sterol Lipids [ST] > Sterols [ST01] > Withanolides and derivatives [ST0116] > - > > - > - > - > - > - > - > - > - > - > 179695 > - > - > Active > Physalolactone C, a New Withanolide from Physalis peruviana J. Nat. Prod 1984 DOI: 10.1021/np50034a013 > https://www.lipidmaps.org/data/LMSDRecord.php?LMID=LMST01160014 $$$$