LMST01130056 LIPID_MAPS_STRUCTURE_DATABASE 43 48 0 0 0 999 V2000 8.4646 8.3606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5987 7.8606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4646 6.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3306 6.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1967 6.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0628 6.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0628 9.8606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1967 9.3606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8799 8.0516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4676 8.8606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8799 10.6697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0139 11.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7459 11.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7459 12.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8799 9.6697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7459 10.1697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8799 12.6698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8799 13.6698 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0139 12.1698 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5987 6.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7327 6.3607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9288 8.3606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9288 7.3607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3306 7.8606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3306 8.8606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9288 9.3606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9288 10.3606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0628 7.8606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0628 8.8606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1967 8.3606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1967 7.3607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3307 9.8606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5732 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 6.7350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3196 7.3652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9143 8.2806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7385 6.4535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1588 5.6379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1600 5.7338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7457 6.6422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3255 7.4578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9111 8.3662 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 1 1 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 > LMST01130056 > Drimianin C > 3-O-beta-D-glucopyranosyl-3beta,11beta,14beta-trihydroxybufa-4,20,22-trienolide > C30H42O10 > 562.28 > Sterol Lipids [ST] > Sterols [ST01] > Bufanolides and derivatives [ST0113] > - > > VHSLHQZGJUWMQQ-PSLIIANDSA-N > InChI=1S/C30H42O10/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/h3,6,11,14,17-21,23-27,31-32,34-37H,4-5,7-10,12-13H2,1-2H3/t17-,18+,19+,20-,21+,23+,24+,25-,26+,27+,28-,29+,30-/m0/s1 > C1[C@@]2(C)C(CC[C@]3([H])[C@]2([H])[C@@H](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 24:5;O5;Hex > - > - > 164615654 > - > - > - > - > - > 65774 > 33478223 $$$$