LMST01010390 LIPID_MAPS_STRUCTURE_DATABASE 51 54 0 0 0 0 0 0 0 0999 V2000 16.3189 10.1382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4423 9.6325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4423 8.6203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3189 8.1144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8248 7.2380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8129 7.2380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0717 8.1144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9482 8.6203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9482 9.6325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8243 10.1382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8039 9.3090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8243 11.1505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8797 11.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0717 11.1505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0717 10.1382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1952 9.6325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1952 10.6443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5660 8.1144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5660 10.1382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7442 7.4404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8676 7.9464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9910 7.4404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1146 7.9464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2382 7.4404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2382 6.4285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4850 6.5640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5552 6.3606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7442 6.4285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7869 9.8255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3817 10.6443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7869 11.4630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0360 12.2615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8202 12.7421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.6044 12.1096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4647 12.7170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.4010 12.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.3755 11.0979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.3117 12.4894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.2358 11.5786 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.4647 13.5013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1952 8.6203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1952 7.6084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3528 12.9195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3528 13.9315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3619 7.9464 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4854 7.4404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6090 7.9464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6090 8.9585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 7.4404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9482 11.6563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9482 12.6683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 41 1 0 0 0 0 41 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 6 0 0 0 10 12 1 0 0 0 0 12 13 1 1 0 0 0 12 50 1 0 0 0 0 50 14 1 0 0 0 0 14 15 1 0 0 0 0 9 15 2 0 0 0 0 15 16 1 0 0 0 0 1 16 1 0 0 0 0 41 16 1 0 0 0 0 16 17 1 1 0 0 0 3 18 1 1 0 0 0 2 19 1 6 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 22 26 1 6 0 0 0 22 27 1 1 0 0 0 20 28 2 0 0 0 0 10 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 12 1 0 0 0 0 31 32 1 1 0 0 0 32 43 1 6 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 35 40 1 1 0 0 0 41 42 1 6 0 0 0 43 44 1 0 0 0 0 20 18 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 2 0 0 0 0 47 49 1 0 0 0 0 50 51 1 6 0 0 0 M END > LMST01010390 > Fasciculic acid C > Lanost-8-ene-2alpha,3beta,12alpha,21,24R,25-hexol, 3-(N-Glycyl-3S-hydroxy-3-methylpentanedioate) > C38H63NO11 > 709.44 > Sterol Lipids [ST] > Sterols [ST01] > Cholesterol and derivatives [ST0101] > - > 3-O-(N-Glycyl-3-hydroxy-3-methylglutaryl)fasciculol C > IOMBMOCSWVAYQU-ZLHZNRRGSA-N > InChI=1S/C38H63NO11/c1-33(2)26-11-10-23-24(15-28(43)38(8)22(13-14-37(23,38)7)21(20-40)9-12-27(42)34(3,4)48)36(26,6)16-25(41)32(33)50-31(47)18-35(5,49)17-29(44)39-19-30(45)46/h21-22,25-28,32,40-43,48-49H,9-20H2,1-8H3,(H,39,44)(H,45,46)/t21-,22+,25+,26-,27+,28-,32-,35-,36+,37-,38-/m0/s1 > C1[C@@]2(C)[C@@]([H])(CCC3=C2C[C@H](O)[C@@]2([C@@H]([C@@H](CC[C@@H](O)C(O)(C)C)CO)CC[C@@]32C)C)C(C)(C)[C@@H](OC(=O)C[C@](O)(C)CC(NCC(O)=O)=O)[C@@H]1O > - > HMDB36440 > - > - > - > - > 73242212 > - > Prenol Lipids [PR] > Isoprenoids [PR01] > C30 isoprenoids (triterpenes) [PR0106] > Lanostane triterpenoids [PR010605] > 72129 > - $$$$