LMST01160021 LIPID_MAPS_STRUCTURE_DATABASE 39 43 0 0 0 999 V2000 5.4291 -2.5534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2878 -3.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2878 -4.0408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4291 -4.5366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5703 -4.0408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5703 -3.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1467 -2.5534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0054 -3.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0054 -4.0408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1467 -4.5366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1466 -1.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0053 -1.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8641 -1.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8641 -2.5533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7229 -1.0658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5817 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5818 -2.5532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4291 -5.5282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2878 -5.0324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2878 -2.0576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8641 -0.5701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1467 -5.5282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7229 -0.0742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5816 0.4217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8640 0.4216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7228 0.9174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5816 1.4133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4403 1.9092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2992 1.4133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2991 0.4217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4403 -0.0741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4403 2.9008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1579 1.9092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1579 -0.0741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1346 -3.3925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0068 -2.2709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4291 -1.5618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7230 -2.0574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5816 -0.5699 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 2 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 14 17 2 0 0 0 4 18 1 1 0 0 3 19 1 1 0 0 2 20 1 1 0 0 13 21 1 1 0 0 10 22 1 6 0 0 15 23 1 0 0 0 23 24 1 0 0 0 23 25 1 6 0 0 23 26 1 0 0 0 24 27 1 0 0 0 27 28 1 0 0 0 28 29 2 0 0 0 29 30 1 0 0 0 30 31 1 0 0 0 31 24 1 0 0 0 28 32 1 0 0 0 29 33 1 0 0 0 30 34 2 0 0 0 7 35 1 6 0 0 8 36 1 1 0 0 1 37 2 0 0 0 15 38 1 1 0 0 24 39 1 6 0 0 M END > LMST01160021 > Withaperuvin B > 17S,20S,22R-4beta,5beta,6alpha,17beta,20alpha-pentahydroxy-1-oxo-ergosta-2,14,24-trienolide > C28H38O8 > 502.26 > Sterol Lipids [ST] > Sterols [ST01] > Withanolides and derivatives [ST0116] > - > > - > HMDB0034191 > - > - > - > - > - > - > - > 3734964 > - > - > Active > Structures of Withaperuvin B and C, Withanolides of Physalis peruviana Roots Heterocycles 1970 DOI: 10.3987/R-1982-01-0037 > https://www.lipidmaps.org/data/LMSDRecord.php?LMID=LMST01160021 $$$$