LMST01040300 LIPID_MAPS_STRUCTURE_DATABASE 39 42 0 0 0 999 V2000 11.2828 8.9670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3945 9.4714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2655 7.9968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5150 8.9585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3859 10.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4030 7.4364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2784 11.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5150 7.9408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6354 9.4586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5063 9.9889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3859 6.4921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6354 7.4321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7687 8.9585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7687 7.9408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8760 9.4757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8717 7.4321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4114 8.7726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5063 7.2207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1667 9.1738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7687 9.9951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2037 10.5106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2037 11.5290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1993 9.4801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1993 8.4617 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1734 10.8214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9374 11.8397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8192 12.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1734 11.8397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2916 12.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0553 12.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5831 12.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7012 10.8214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7012 11.8397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5831 11.3305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1734 12.8604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7181 11.2198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8192 13.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6852 13.8490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0552 13.3489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 2 17 1 6 0 0 0 3 6 1 0 0 0 0 21 7 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 1 0 0 0 5 7 1 0 0 0 0 6 11 2 0 0 0 0 6 8 1 0 0 0 0 8 12 1 0 0 0 0 8 18 1 1 0 0 0 9 13 1 0 0 0 0 12 14 1 0 0 0 0 13 15 1 1 0 0 0 13 14 1 0 0 0 0 14 16 1 1 0 0 0 25 21 1 0 0 0 0 21 23 1 0 0 0 0 23 19 1 0 0 0 0 25 20 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 1 0 0 0 23 24 1 6 0 0 0 25 28 1 0 0 0 0 28 30 1 0 0 0 0 30 26 1 0 0 0 0 26 27 1 0 0 0 0 27 33 1 0 0 0 0 28 29 1 6 0 0 0 33 31 1 0 0 0 0 33 32 1 0 0 0 0 33 34 1 0 0 0 0 28 35 1 1 0 0 25 36 1 6 0 0 0 27 37 1 6 0 0 37 38 1 0 0 0 30 39 1 6 0 0 M END > LMST01040300 > Lemmasterone > 2beta,3beta,14alpha,20R,23R,25-hexahydroxy-5beta-Poriferasta-7-en-6-one > C29H48O7 > 508.34 > Sterol Lipids [ST] > Sterols [ST01] > Stigmasterols and C24-ethyl derivatives [ST0104] > - > > CIQDSODCPIIBBH-VFCLXSBCSA-N > InChI=1S/C29H48O7/c1-7-16(25(2,3)34)12-24(33)28(6,35)23-9-11-29(36)18-13-20(30)19-14-21(31)22(32)15-26(19,4)17(18)8-10-27(23,29)5/h13,16-17,19,21-24,31-36H,7-12,14-15H2,1-6H3/t16-,17-,19-,21+,22-,23-,24+,26+,27+,28+,29+/m0/s1 > C12=CC([C@]3([H])C[C@@H](O)[C@@H](O)C[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2(O)CC[C@]1([H])[C@](O)(C)[C@H](O)C[C@H](CC)C(O)(C)C)=O > - > - > - > ST 29:2;O7 > - > - > 12304990 > - > - > - > - > - > 449854 > - $$$$