LMST01130059 LIPID_MAPS_STRUCTURE_DATABASE 43 48 0 0 0 999 V2000 8.4647 8.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5988 7.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4647 6.3608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3307 6.8608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1968 6.3608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0629 6.8608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0629 9.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1968 9.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8800 8.0517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4677 8.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8800 10.6698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0140 11.1699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7460 11.1699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7460 12.1699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8800 9.6698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7460 10.1698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8800 12.6699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8800 13.6699 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0140 12.1699 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5988 6.8608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7328 6.3608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9289 8.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9289 7.3608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3307 7.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3307 8.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9289 9.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9289 10.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0629 7.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0629 8.8607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1968 8.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1968 7.3608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3308 9.8607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5733 4.7294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5804 4.9181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7515 6.7351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3197 7.3653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9143 8.2807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7386 6.4536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1588 5.6380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1600 5.7339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7457 6.6423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3255 7.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9111 8.3663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 2 20 1 0 0 0 0 20 3 1 0 0 0 0 3 4 2 0 0 0 0 30 24 1 0 0 0 0 24 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 28 1 0 0 0 0 28 22 1 0 0 0 0 30 28 1 0 0 0 0 8 30 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 15 26 1 0 0 0 0 26 22 1 0 0 0 0 22 9 1 0 0 0 0 15 10 1 0 0 0 0 9 10 1 0 0 0 0 15 11 1 0 0 0 0 12 11 2 0 0 0 0 11 13 1 0 0 0 0 17 19 1 0 0 0 0 17 14 1 0 0 0 0 19 12 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 6 0 0 0 17 18 2 0 0 0 0 20 21 1 1 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 1 1 0 0 0 30 31 1 6 0 0 0 8 32 2 0 0 0 37 43 1 0 0 0 42 36 1 0 0 0 36 38 1 0 0 0 38 39 1 0 0 0 39 40 1 0 0 0 40 41 1 0 0 0 41 42 1 0 0 0 42 43 1 1 0 0 38 21 1 1 0 0 39 33 1 6 0 0 40 34 1 1 0 0 41 35 1 6 0 0 M END > LMST01130059 > Drimianin D > 3-O-beta-D-glucopyranosyl-3beta,14beta-dihydroxy-11-oxobufa-4,20,22-trienolide > C30H40O10 > 560.26 > Sterol Lipids [ST] > Sterols [ST01] > Bufanolides and derivatives [ST0113] > - > > BJYSJPFYGKJQKG-UMUKGESXSA-N > InChI=1S/C30H40O10/c1-28-9-7-17(39-27-26(36)25(35)24(34)21(13-31)40-27)11-16(28)4-5-19-23(28)20(32)12-29(2)18(8-10-30(19,29)37)15-3-6-22(33)38-14-15/h3,6,11,14,17-19,21,23-27,31,34-37H,4-5,7-10,12-13H2,1-2H3/t17-,18+,19+,21+,23+,24+,25-,26+,27+,28-,29+,30-/m0/s1 > C1[C@@]2(C)C(CC[C@]3([H])[C@]2([H])C(=O)C[C@@]2(C)[C@]3(O)CC[C@]2([H])C2C=CC(=O)OC=2)=C[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C1 > - > - > - > ST 24:6;O5;Hex > - > - > 171120116 > - > - > - > - > - > 65774 > 33478223 $$$$